CAS RN: 99966-13-9
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-iodo-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-iodo-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-iodo-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-iodanyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10IN2O7P
MOLECULAR WEIGHT: 416.063131
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)I
Structure:
CAS RN: 99966-22-0
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-bromo-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-bromo-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-bromo-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-bromanyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10BrN2O7P
MOLECULAR WEIGHT: 369.062661
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)Br
Structure:
CAS RN: 99966-23-1
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-bromo-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-bromo-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-bromo-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-bromanyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10BrN2O7P
MOLECULAR WEIGHT: 369.062661
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)Br
Structure:
CAS RN: 99966-12-8
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-chloro-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-chloro-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-chloro-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-chloranyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10ClN2O7P
MOLECULAR WEIGHT: 324.611661
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)Cl
Structure:
CAS RN: 99966-15-1
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-chloro-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-chloro-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-chloro-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-chloranyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10ClN2O7P
MOLECULAR WEIGHT: 324.611661
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)Cl
Structure:
CAS RN: 100019-64-5
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-fluoro-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-fluoro-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-fluoro-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-fluoranyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10FN2O7P
MOLECULAR WEIGHT: 308.157064
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)F
Structure:
CAS RN: 36519-08-1
CAS Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-fluoro-1H-pyrimidine-2,4-dione
OPENEYE Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-fluoro-1H-pyrimidine-2,4-dione
IUPAC Name: 6-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-fluoro-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-fluoranyl-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H10FN2O7P
MOLECULAR WEIGHT: 308.157064
SMILES: C1[C@H]2[C@@H](COP(=O)(O2)O)O[C@H]1C3=C(C(=O)NC(=O)N3)F
Structure:
CAS RN: 107680-33-1
CAS Name: 3-methyl-2-phenyl-1-(1,2,4-triazol-1-yl)butane-2,3-diol
OPENEYE Name: 3-methyl-2-phenyl-1-(1,2,4-triazol-1-yl)butane-2,3-diol
IUPAC Name: 3-methyl-2-phenyl-1-(1,2,4-triazol-1-yl)butane-2,3-diol
SYSTEMATIC NAME: 3-methyl-2-phenyl-1-(1,2,4-triazol-1-yl)butane-2,3-diol
MOLECULAR FORMULA: C13H17N3O2
MOLECULAR WEIGHT: 247.29298
SMILES: CC(C)(C(CN1C=NC=N1)(C2=CC=CC=C2)O)O
Structure:
CAS RN: 107680-22-8
CAS Name: 1,1-bis(4-chlorophenyl)-3-methyl-2-(1,2,4-triazol-1-ylmethyl)butane-1,2-diol
OPENEYE Name: 1,1-bis(4-chlorophenyl)-3-methyl-2-(1,2,4-triazol-1-ylmethyl)butane-1,2-diol
IUPAC Name: 1,1-bis(4-chlorophenyl)-3-methyl-2-(1,2,4-triazol-1-ylmethyl)butane-1,2-diol
SYSTEMATIC NAME: 1,1-bis(4-chlorophenyl)-3-methyl-2-(1,2,4-triazol-1-ylmethyl)butane-1,2-diol
MOLECULAR FORMULA: C20H21Cl2N3O2
MOLECULAR WEIGHT: 406.30564
SMILES: CC(C)C(CN1C=NC=N1)(C(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)O)O
Structure:
CAS RN: 107659-44-9
CAS Name: (1S,2R)-3-(1-imidazolyl)-1,2-diphenylpropane-1,2-diol
OPENEYE Name: (1S,2R)-3-imidazol-1-yl-1,2-diphenyl-propane-1,2-diol
IUPAC Name: (1S,2R)-3-imidazol-1-yl-1,2-diphenylpropane-1,2-diol
SYSTEMATIC NAME: (1S,2R)-3-imidazol-1-yl-1,2-diphenyl-propane-1,2-diol
MOLECULAR FORMULA: C18H18N2O2
MOLECULAR WEIGHT: 294.34772
SMILES: C1=CC=C(C=C1)[C@@H]([C@](CN2C=CN=C2)(C3=CC=CC=C3)O)O
Structure:
CAS RN: 108664-30-8
CAS Name: 3-[3-(4-chlorophenyl)-3-oxoprop-1-en-2-yl]-4-methyl-4H-pyrimidine-2,5-dione
OPENEYE Name: 3-[1-(4-chlorobenzoyl)vinyl]-4-methyl-4H-pyrimidine-2,5-dione
IUPAC Name: 3-[3-(4-chlorophenyl)-3-oxoprop-1-en-2-yl]-4-methyl-4H-pyrimidine-2,5-dione
SYSTEMATIC NAME: 3-[3-(4-chlorophenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-4H-pyrimidine-2,5-dione
MOLECULAR FORMULA: C14H11ClN2O3
MOLECULAR WEIGHT: 290.70174
SMILES: CC1C(=O)C=NC(=O)N1C(=C)C(=O)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 99606-26-5
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-octylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-octyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-octylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-octyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C17H27N2O7P
MOLECULAR WEIGHT: 402.379241
SMILES: CCCCCCCCC1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 99606-25-4
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-hexylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-hexyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-hexylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-hexyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C15H23N2O7P
MOLECULAR WEIGHT: 374.326081
SMILES: CCCCCCC1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 99617-57-9
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-pentylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-pentyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-pentylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-pentyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C14H21N2O7P
MOLECULAR WEIGHT: 360.299501
SMILES: CCCCCC1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 99606-24-3
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-butylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-butyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-butylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-butyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C13H19N2O7P
MOLECULAR WEIGHT: 346.272921
SMILES: CCCCC1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 99606-23-2
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-propylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-propyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-propylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-propyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C12H17N2O7P
MOLECULAR WEIGHT: 332.246341
SMILES: CCCC1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 99606-22-1
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-propan-2-ylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-isopropyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-propan-2-ylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-propan-2-yl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C12H17N2O7P
MOLECULAR WEIGHT: 332.246341
SMILES: CC(C)C1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 99606-21-0
CAS Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-5-ethylpyrimidine-2,4-dione
OPENEYE Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-ethyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(4aR,6R,7aS)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-ethylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(4aR,6R,7aS)-2-oxidanyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-ethyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H15N2O7P
MOLECULAR WEIGHT: 318.219761
SMILES: CCC1=CN(C(=O)NC1=O)[C@H]2C[C@H]3[C@H](O2)COP(=O)(O3)O
Structure:
CAS RN: 2488-25-7
CAS Name: N-[(2S,3R)-1-[[(2S)-1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[(1S,2R)-1-[[(1S)-2-hydrazino-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]-2-hydroxy-propyl]carbamate
IUPAC Name: benzyl N-[(2S,3R)-1-[[(2S)-1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[(2S,3R)-1-[[(2S)-1-diazanyl-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]carbamate
MOLECULAR FORMULA: C15H22N4O6
MOLECULAR WEIGHT: 354.35838
SMILES: C[C@H]([C@@H](C(=O)N[C@@H](CO)C(=O)NN)NC(=O)OCC1=CC=CC=C1)O
Structure:
CAS RN: 127306-17-6
CAS Name: (2S)-2-[[(2S,3S)-2-[[[(2S)-1-[(2R,3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methyl-1-oxopentyl]amino]-4-amino-1,4-dioxobutyl]amino]-2-hydroxy-4-phenylbutyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]amino]-3-methylbutanoic acid methyl ester
OPENEYE Name: methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2R,3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methyl-pentanoyl]amino]-4-amino-4-oxo-butanoyl]amino]-2-hydroxy-4-phenyl-butyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butanoate
IUPAC Name: methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2R,3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-2-hydroxy-4-phenylbutyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoate
SYSTEMATIC NAME: methyl (2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2R,3S)-3-[[(2S)-2-[[(2S)-2-acetamido-4-methyl-pentanoyl]amino]-4-azanyl-4-oxidanylidene-butanoyl]amino]-2-oxidanyl-4-phenyl-butyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-methyl-butanoate
MOLECULAR FORMULA: C39H63N7O9
MOLECULAR WEIGHT: 773.95902
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)OC)NC(=O)[C@@H]1CCCN1C[C@H]([C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)C)O
Structure:
CAS RN: 7059-24-7
CAS Name: acetic acid [(2S,3R,4S)-6-[[(6S,7S)-6-[[(4R,5R,6R)-4-[[(4S,5S,6S)-4-[[(4S,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyl-2-oxanyl]oxy]-5-hydroxy-6-methyl-2-oxanyl]oxy]-5-hydroxy-6-methyl-2-oxanyl]oxy]-7-[(1R,3S,4S)-3,4-dihydroxy-1-methoxy-2-oxopentyl]-4,10-dih
OPENEYE Name: [(2S,3R,4S)-6-[[(6S,7S)-6-[(4R,5R,6R)-4-[(4S,5S,6S)-4-[(4S,5S,6S)-5-acetoxy-4-hydroxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-7-[(1R,3S,4S)-3,4-dihydroxy-1-methoxy-2-oxo
IUPAC Name: [(2S,3R,4S)-6-[[(6S,7S)-6-[(4R,5R,6R)-4-[(4S,5S,6S)-4-[(4S,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-7-[(1R,3S,4S)-3,4-dihydroxy-1-methoxy-2-oxopentyl]-4,10-dihydroxy-3-methyl-5-
SYSTEMATIC NAME: [(2S,3R,4S)-6-[[(6S,7S)-6-[(4R,5R,6R)-4-[(4S,5S,6S)-4-[(4S,5S,6S)-5-acetyloxy-4,6-dimethyl-4-oxidanyl-oxan-2-yl]oxy-6-methyl-5-oxidanyl-oxan-2-yl]oxy-6-methyl-5-oxidanyl-oxan-2-yl]oxy-7-[(1R,3S,4S)-1-methoxy-3,4-bis(oxidanyl)-2-oxidanylidene-pentyl]-3-met
MOLECULAR FORMULA: C57H82O26
MOLECULAR WEIGHT: 1183.24538
SMILES: C[C@@H]1[C@H]([C@@H](CC(O1)O[C@H]2[C@@H](CC3=C(C2=O)C(=C4C(=C3)C=C(C(=C4O)C)OC5C[C@@H]([C@@H]([C@@H](O5)C)OC(=O)C)OC6C[C@@H]([C@@H]([C@@H](O6)C)OC)O)O)[C@H](C(=O)[C@H]([C@H](C)O)O)OC)OC7C[C@@H]([C@H]([C@@H](O7)C)O)OC8C[C@]([C@H]([C@@H](O8)C)OC(=O)C)(C)O)O
Structure:
CAS RN: 4135-85-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H54N2O12
MOLECULAR WEIGHT: 754.86296
SMILES: C[C@H]1/C=C/C=C(\C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C(=C2CN(C)C)O)O)/C
Structure:
CAS RN: 16009-13-5
CAS Name: 3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethyl-2-porphyrin-21,24-diidyl]propanoic acid; iron(3+)
OPENEYE Name: ferric 3-[18-(2-carboxyethyl)-3,7,12,17-tetramethyl-8,13-divinyl-porphyrin-21,24-diid-2-yl]propanoic acid
IUPAC Name: 3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoic acid; iron(3+)
SYSTEMATIC NAME: 3-[8,13-bis(ethenyl)-18-(3-hydroxy-3-oxopropyl)-3,7,12,17-tetramethyl-porphyrin-21,24-diid-2-yl]propanoic acid; iron(3+)
MOLECULAR FORMULA: C34H32FeN4O4+
MOLECULAR WEIGHT: 616.48728
SMILES: CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C)CCC(=O)O)CCC(=O)O.[Fe+3]
Structure:
CAS RN: 122002-76-0
CAS Name: 4-[3-[4-[3-(ethylamino)-2-pyridinyl]-1-piperazinyl]propyl]-2,6-dimethylphenol
OPENEYE Name: 4-[3-[4-[3-(ethylamino)-2-pyridyl]piperazin-1-yl]propyl]-2,6-dimethyl-phenol
IUPAC Name: 4-[3-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]propyl]-2,6-dimethylphenol
SYSTEMATIC NAME: 4-[3-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]propyl]-2,6-dimethyl-phenol
MOLECULAR FORMULA: C22H32N4O
MOLECULAR WEIGHT: 368.51568
SMILES: CCNC1=C(N=CC=C1)N2CCN(CC2)CCCC3=CC(=C(C(=C3)C)O)C
Structure:
CAS RN: 122004-46-0
CAS Name: 4-[3-[4-[3-(ethylamino)-2-pyridinyl]-1-piperazinyl]propyl]-2,6-dimethylphenol
OPENEYE Name: 4-[3-[4-[3-(ethylamino)-2-pyridyl]piperazin-1-yl]propyl]-2,6-dimethyl-phenol
IUPAC Name: 4-[3-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]propyl]-2,6-dimethylphenol
SYSTEMATIC NAME: 4-[3-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]propyl]-2,6-dimethyl-phenol
MOLECULAR FORMULA: C22H32N4O
MOLECULAR WEIGHT: 368.51568
SMILES: CCNC1=C(N=CC=C1)N2CCN(CC2)CCCC3=CC(=C(C(=C3)C)O)C
Structure:
CAS RN: 122002-80-6
CAS Name: 4-[2-[4-[3-(ethylamino)-2-pyridinyl]-1-piperazinyl]ethyl]-2,6-dimethylphenol
OPENEYE Name: 4-[2-[4-[3-(ethylamino)-2-pyridyl]piperazin-1-yl]ethyl]-2,6-dimethyl-phenol
IUPAC Name: 4-[2-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]ethyl]-2,6-dimethylphenol
SYSTEMATIC NAME: 4-[2-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]ethyl]-2,6-dimethyl-phenol
MOLECULAR FORMULA: C21H30N4O
MOLECULAR WEIGHT: 354.4891
SMILES: CCNC1=C(N=CC=C1)N2CCN(CC2)CCC3=CC(=C(C(=C3)C)O)C
Structure:
CAS RN: 122004-41-5
CAS Name: 4-[2-[4-[3-(ethylamino)-2-pyridinyl]-1-piperazinyl]ethyl]-2,6-dimethylphenol
OPENEYE Name: 4-[2-[4-[3-(ethylamino)-2-pyridyl]piperazin-1-yl]ethyl]-2,6-dimethyl-phenol
IUPAC Name: 4-[2-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]ethyl]-2,6-dimethylphenol
SYSTEMATIC NAME: 4-[2-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]ethyl]-2,6-dimethyl-phenol
MOLECULAR FORMULA: C21H30N4O
MOLECULAR WEIGHT: 354.4891
SMILES: CCNC1=C(N=CC=C1)N2CCN(CC2)CCC3=CC(=C(C(=C3)C)O)C
Structure:
CAS RN: 122002-78-2
CAS Name: N-ethyl-2-[4-[3-(4-methoxy-3,5-dimethylphenyl)propyl]-1-piperazinyl]-3-pyridinamine
OPENEYE Name: N-ethyl-2-[4-[3-(4-methoxy-3,5-dimethyl-phenyl)propyl]piperazin-1-yl]pyridin-3-amine
IUPAC Name: N-ethyl-2-[4-[3-(4-methoxy-3,5-dimethylphenyl)propyl]piperazin-1-yl]pyridin-3-amine
SYSTEMATIC NAME: N-ethyl-2-[4-[3-(4-methoxy-3,5-dimethyl-phenyl)propyl]piperazin-1-yl]pyridin-3-amine
MOLECULAR FORMULA: C23H34N4O
MOLECULAR WEIGHT: 382.54226
SMILES: CCNC1=C(N=CC=C1)N2CCN(CC2)CCCC3=CC(=C(C(=C3)C)OC)C
Structure:
CAS RN: 61914-36-1
CAS Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)-1-cyclopentanol
OPENEYE Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopentanol
IUPAC Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopentan-1-ol
SYSTEMATIC NAME: (1S,2R,3S,5R)-5-(6-aminopurin-9-yl)-2-azanyl-3-(hydroxymethyl)cyclopentan-1-ol
MOLECULAR FORMULA: C11H16N6O2
MOLECULAR WEIGHT: 264.28374
SMILES: C1[C@@H]([C@H]([C@@H]([C@@H]1N2C=NC3=C2N=CN=C3N)O)N)CO
Structure:
CAS RN: 118333-17-8
CAS Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)-1-cyclopentanol
OPENEYE Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopentanol
IUPAC Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopentan-1-ol
SYSTEMATIC NAME: (1S,2R,3S,5R)-5-(6-aminopurin-9-yl)-2-azanyl-3-(hydroxymethyl)cyclopentan-1-ol
MOLECULAR FORMULA: C11H16N6O2
MOLECULAR WEIGHT: 264.28374
SMILES: C1[C@@H]([C@H]([C@@H]([C@@H]1N2C=NC3=C2N=CN=C3N)O)N)CO
Structure:
CAS RN: 65941-38-0
CAS Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)-1-cyclopentanol
OPENEYE Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopentanol
IUPAC Name: (1S,2R,3S,5R)-2-amino-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopentan-1-ol
SYSTEMATIC NAME: (1S,2R,3S,5R)-5-(6-aminopurin-9-yl)-2-azanyl-3-(hydroxymethyl)cyclopentan-1-ol
MOLECULAR FORMULA: C11H16N6O2
MOLECULAR WEIGHT: 264.28374
SMILES: C1[C@@H]([C@H]([C@@H]([C@@H]1N2C=NC3=C2N=CN=C3N)O)N)CO
Structure:
CAS RN: 98818-73-6
CAS Name: N-[(2S)-1-[[(2S)-1-[[(2S,3S)-6-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-6-oxo-1-phenyl-5-(phenylmethyl)hexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid te
OPENEYE Name: tert-butyl N-[(1S)-2-[[(1S)-2-[[(1S,2S)-5-[[(1S)-1-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1,4-dibenzyl-2-hydroxy-5-oxo-pentyl]amino]-1-benzyl-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S,3S)-6-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-5-benzyl-3-hydroxy-6-oxo-1-phenylhexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S,3S)-6-[[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]amino]-1-oxidanylidene-3-phenyl-propa
MOLECULAR FORMULA: C57H70N6O8
MOLECULAR WEIGHT: 967.2011
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)NC(=O)C(CC2=CC=CC=C2)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@H](CC5=CC=CC=C5)NC(=O)OC(C)(C)C)O
Structure:
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