CAS RN: 13292-22-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C38H47NO13
MOLECULAR WEIGHT: 725.77868
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(=C2C=O)O)O)/C
Structure:
CAS RN: 4075-41-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C42H58N2O12
MOLECULAR WEIGHT: 782.91612
SMILES: CCN(CC)CC1=C(C2=C3C(=C(C4=C2C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C/C=C(\C(=O)NC1=C3O)/C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O)O
Structure:
CAS RN: 121923-96-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H28O3
MOLECULAR WEIGHT: 292.41312
SMILES: CCC1C2C[C@H]3C(C2/C=C/CCCCCCCC(=O)O1)O3
Structure:
CAS RN: 13283-90-4
CAS Name: 9a-methyl-3-(1-oxooctyl)-6-[(E)-prop-1-enyl]furo[3,2-g][2]benzopyran-2,9-dione
OPENEYE Name: 9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isochromene-2,9-dione
IUPAC Name: 9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isochromene-2,9-dione
SYSTEMATIC NAME: 9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isochromene-2,9-dione
MOLECULAR FORMULA: C23H26O5
MOLECULAR WEIGHT: 382.44954
SMILES: CCCCCCCC(=O)C1=C2C=C3C=C(OC=C3C(=O)C2(OC1=O)C)/C=C/C
Structure:
CAS RN: 55623-37-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H25N5O4
MOLECULAR WEIGHT: 447.4864
SMILES: CC(C)(C=C)[C@]12C=C(C(=O)N\3C1(NC(=O)/C3=C\C4=CN=CN4)N(C5=CC=CC=C25)OC)OC
Structure:
CAS RN: 154204-06-5
CAS Name: 2-[2-[(4E,6E)-3,5-dimethyl-2-oxoocta-4,6-dienyl]-6-oxo-4-oxanyl]acetamide
OPENEYE Name: 2-[2-[(4E,6E)-3,5-dimethyl-2-oxo-octa-4,6-dienyl]-6-oxo-tetrahydropyran-4-yl]acetamide
IUPAC Name: 2-[2-[(4E,6E)-3,5-dimethyl-2-oxoocta-4,6-dienyl]-6-oxooxan-4-yl]acetamide
SYSTEMATIC NAME: 2-[2-[(4E,6E)-3,5-dimethyl-2-oxidanylidene-octa-4,6-dienyl]-6-oxidanylidene-oxan-4-yl]ethanamide
MOLECULAR FORMULA: C17H25NO4
MOLECULAR WEIGHT: 307.3847
SMILES: C/C=C/C(=C/C(C)C(=O)CC1CC(CC(=O)O1)CC(=O)N)/C
Structure:
CAS RN: 73341-73-8
CAS Name: carbamic acid [(4E,6E,10E)-20,22-dihydroxy-13,14,17-trimethoxy-4,8,10,12,16-pentamethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] ester
OPENEYE Name: [(4E,6E,10E)-20,22-dihydroxy-13,14,17-trimethoxy-4,8,10,12,16-pentamethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate
IUPAC Name: [(4E,6E,10E)-20,22-dihydroxy-13,14,17-trimethoxy-4,8,10,12,16-pentamethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate
SYSTEMATIC NAME: [(4E,6E,10E)-13,14,17-trimethoxy-4,8,10,12,16-pentamethyl-20,22-bis(oxidanyl)-3-oxidanylidene-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate
MOLECULAR FORMULA: C30H44N2O8
MOLECULAR WEIGHT: 560.67896
SMILES: CC1CC(C(C(/C=C(/C(C(/C=C/C=C(/C(=O)NC2=C(C(=CC(=C2)O)C1OC)O)\C)C)OC(=O)N)\C)C)OC)OC
Structure:
CAS RN: 50335-03-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H36N2O5
MOLECULAR WEIGHT: 528.63864
SMILES: C[C@H]\1C/C=C/[C@H]2[C@H]3[C@](O3)([C@H]([C@@H]4[C@@]2(C(=O)/C=C/C(=O)[C@@H](/C(=C1)/C)O)C(=O)N[C@H]4CC5=CNC6=CC=CC=C65)C)C
Structure:
CAS RN: 65669-72-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H30O4
MOLECULAR WEIGHT: 334.4498
SMILES: C/C/1=C/CC[C@@]([C@@H]2C[C@H](CC[C@@]3([C@H](O3)CC1)C)C(=C)C(=O)O2)(C)O
Structure:
CAS RN: 132905-42-1
CAS Name: (8E,16E)-19-(3,3-dimethyl-2-oxiranyl)-N,N,4,8,13,17-hexamethyl-1-nonadeca-4,8,12,16-tetraenamine
OPENEYE Name: (8E,16E)-19-(3,3-dimethyloxiran-2-yl)-N,N,4,8,13,17-hexamethyl-nonadeca-4,8,12,16-tetraen-1-amine
IUPAC Name: (8E,16E)-19-(3,3-dimethyloxiran-2-yl)-N,N,4,8,13,17-hexamethylnonadeca-4,8,12,16-tetraen-1-amine
SYSTEMATIC NAME: (8E,16E)-19-(3,3-dimethyloxiran-2-yl)-N,N,4,8,13,17-hexamethyl-nonadeca-4,8,12,16-tetraen-1-amine
MOLECULAR FORMULA: C29H51NO
MOLECULAR WEIGHT: 429.72134
SMILES: CC(=CCC/C(=C/CCC=C(C)CC/C=C(\C)/CCC1C(O1)(C)C)/C)CCCN(C)C
Structure:
CAS RN: 168569-27-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H38O11
MOLECULAR WEIGHT: 550.59472
SMILES: C[C@@H]1CC(C(=O)[C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H](C(C([C@@H]4C(C(=O)O3)OC(=O)/C=C(\C)/C(C)C)(OC5)C(=O)OC)O)O)C)O
Structure:
CAS RN: 34707-92-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C50H63ClO16
MOLECULAR WEIGHT: 955.47862
SMILES: C[C@@H]1C[C@@]23[C@H](/C=C/CCCC[C@@H]4C=C[C@H]5[C@H]([C@@]4(C(=O)OC(=C(O2)O)C3=O)C)CCC[C@@H]5OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC(=O)C8=C(C=CC(=C8C)Cl)OC)O)C=C1C(=O)O
Structure:
CAS RN: 115204-07-4
CAS Name: 2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-4-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylene-2-oxanyl]-1-oxoethyl]amino]-8-methoxy-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-hydroxy-1-oxododeca-2,4,6-trienyl]amino
OPENEYE Name: 2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-4-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylene-tetrahydropyran-2-yl]acetyl]amino]-8-methoxy-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-hydroxy-dodeca-2,4,6-trienoyl]am
IUPAC Name: 2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-4-[[(2S)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]amino]-8-methoxy-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-hydroxydodeca-2,4,6-trienoyl]amino]-5-(dia
SYSTEMATIC NAME: 2-[[(2E,4E,6E,11R)-12-[(4aS,6R,8S,8aR)-8-methoxy-4-[[(2S)-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylidene-oxan-2-yl]-2-oxidanyl-ethanoyl]amino]-7,7-dimethyl-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-yl]-11-oxidanyl-dodeca-2,4,6-trienoyl]amino]
MOLECULAR FORMULA: C39H63N5O12
MOLECULAR WEIGHT: 793.94382
SMILES: C[C@H]1[C@H](O[C@](CC1=C)([C@@H](C(=O)NC2[C@@H]3[C@@H]([C@H](C([C@H](O3)C[C@@H](CCC/C=C/C=C/C=C/C(=O)NC(CCCN=C(N)N)C(=O)O)O)(C)C)OC)OCO2)O)OC)C
Structure:
CAS RN: 81604-73-1
CAS Name: carbamic acid [(2R,3S,4S)-6-[[(2E,7R,8E,10R,12R)-11,17-dihydroxy-2,10,12,20-tetramethyl-13-[(2R,4R)-4-[3-methyl-3-(1-oxopropyl)-2-oxiranyl]pentan-2-yl]-15-oxo-14,21-dioxabicyclo[15.3.1]heneicosa-2,8,19-trien-7-yl]oxy]-3-hydroxy-2-methyl-4-oxanyl] ester
OPENEYE Name: [(2R,3S,4S)-6-[[(2E,7R,8E,10R,12R)-11,17-dihydroxy-2,10,12,20-tetramethyl-13-[(1R,3R)-1-methyl-3-(3-methyl-3-propanoyl-oxiran-2-yl)butyl]-15-oxo-14,21-dioxabicyclo[15.3.1]henicosa-2,8,19-trien-7-yl]oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl] carbamate
IUPAC Name: [(2R,3S,4S)-6-[[(2E,7R,8E,10R,12R)-11,17-dihydroxy-2,10,12,20-tetramethyl-13-[(2R,4R)-4-(3-methyl-3-propanoyloxiran-2-yl)pentan-2-yl]-15-oxo-14,21-dioxabicyclo[15.3.1]henicosa-2,8,19-trien-7-yl]oxy]-3-hydroxy-2-methyloxan-4-yl] carbamate
SYSTEMATIC NAME: [(2R,3S,4S)-2-methyl-3-oxidanyl-6-[[(2E,7R,8E,10R,12R)-2,10,12,20-tetramethyl-13-[(2R,4R)-4-(3-methyl-3-propanoyl-oxiran-2-yl)pentan-2-yl]-11,17-bis(oxidanyl)-15-oxidanylidene-14,21-dioxabicyclo[15.3.1]henicosa-2,8,19-trien-7-yl]oxy]oxan-4-yl] carbamate
MOLECULAR FORMULA: C41H65NO12
MOLECULAR WEIGHT: 763.9543
SMILES: CCC(=O)C1(C(O1)[C@H](C)C[C@@H](C)C2[C@@H](C([C@@H](/C=C/[C@@H](CCC/C=C(/C3C(=CCC(O3)(CC(=O)O2)O)C)\C)OC4C[C@@H]([C@H]([C@H](O4)C)O)OC(=O)N)C)O)C)C
Structure:
CAS RN: 37244-00-1
CAS Name: (3Z,11Z)-8,16-bis(2-oxopropyl)-1,9-dioxacyclohexadeca-3,11-diene-2,5,10,13-tetrone
OPENEYE Name: (3Z,11Z)-8,16-diacetonyl-1,9-dioxacyclohexadeca-3,11-diene-2,5,10,13-tetrone
IUPAC Name: (3Z,11Z)-8,16-bis(2-oxopropyl)-1,9-dioxacyclohexadeca-3,11-diene-2,5,10,13-tetrone
SYSTEMATIC NAME: (3Z,11Z)-8,16-bis(2-oxidanylidenepropyl)-1,9-dioxacyclohexadeca-3,11-diene-2,5,10,13-tetrone
MOLECULAR FORMULA: C20H24O8
MOLECULAR WEIGHT: 392.39976
SMILES: CC(=O)CC1OC(=O)/C=C\C(=O)CCC(OC(=O)/C=C\C(=O)CC1)CC(=O)C
Structure:
CAS RN: 33880-66-9
CAS Name: (E)-2-methyl-2-butenoic acid [(6E,10Z)-8-hydroxy-6-(hydroxymethyl)-10-methyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] ester
OPENEYE Name: [(6E,10Z)-8-hydroxy-6-(hydroxymethyl)-10-methyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-2-methylbut-2-enoate
IUPAC Name: [(6E,10Z)-8-hydroxy-6-(hydroxymethyl)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-2-methylbut-2-enoate
SYSTEMATIC NAME: [(6E,10Z)-6-(hydroxymethyl)-10-methyl-3-methylidene-8-oxidanyl-2-oxidanylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-2-methylbut-2-enoate
MOLECULAR FORMULA: C20H26O6
MOLECULAR WEIGHT: 362.41684
SMILES: C/C=C(\C)/C(=O)OC1C/C(=C\C(C/C(=C\C2C1C(=C)C(=O)O2)/C)O)/CO
Structure:
CAS RN: 15265-28-8
CAS Name: (2R,3R,5S,6R)-5-[(1E,3E)-hepta-1,3-dienyl]-2,3-dihydroxy-6-(hydroxymethyl)-1-cyclohexanone
OPENEYE Name: (2R,3R,5S,6R)-5-[(1E,3E)-hepta-1,3-dienyl]-2,3-dihydroxy-6-(hydroxymethyl)cyclohexanone
IUPAC Name: (2R,3R,5S,6R)-5-[(1E,3E)-hepta-1,3-dienyl]-2,3-dihydroxy-6-(hydroxymethyl)cyclohexan-1-one
SYSTEMATIC NAME: (2R,3S,5R,6R)-3-[(1E,3E)-hepta-1,3-dienyl]-2-(hydroxymethyl)-5,6-bis(oxidanyl)cyclohexan-1-one
MOLECULAR FORMULA: C14H22O4
MOLECULAR WEIGHT: 254.32208
SMILES: CCC/C=C/C=C/[C@@H]1C[C@H]([C@H](C(=O)[C@H]1CO)O)O
Structure:
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