CAS RN: 192575-90-9
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1,3-bis(3-hydroxypropyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1,3-bis(3-hydroxypropyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1,3-bis(3-hydroxypropyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-5,6-bis(oxidanyl)-1,3-bis(3-oxidanylpropyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C25H34N2O5
MOLECULAR WEIGHT: 442.54786
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCO)CCCO)CC3=CC=CC=C3)O)O
Structure:
CAS RN: 180791-05-3
CAS Name: 2-(propylthio)-4-pyridinecarbothioamide
OPENEYE Name: 2-propylsulfanylpyridine-4-carbothioamide
IUPAC Name: 2-propylsulfanylpyridine-4-carbothioamide
SYSTEMATIC NAME: 2-propylsulfanylpyridine-4-carbothioamide
MOLECULAR FORMULA: C9H12N2S2
MOLECULAR WEIGHT: 212.33498
SMILES: CCCSC1=NC=CC(=C1)C(=S)N
Structure:
CAS RN: 62534-68-3
CAS Name: 3-[[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-heptaene-38-carbo
OPENEYE Name: methyl 3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxo-hexyl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14
IUPAC Name: methyl 3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-heptaene-38-
SYSTEMATIC NAME: methyl 3-[(2R,3S,4S,5S,6R)-4-azanyl-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-18-methyl-19-[7-[4-(methylamino)phenyl]-5-oxidanyl-7-oxidanylidene-heptan-2-yl]-23,27,29,31,33,35,37-heptakis(oxidanyl)-21,25-bis(oxidanylidene)-20,39-dioxabicyclo[33.3.1]nonatria
MOLECULAR FORMULA: C60H88N2O19
MOLECULAR WEIGHT: 1141.34272
SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC2CC3C(C(CC(O3)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC(C(C=CC=CC=CC=CC=CC=CC=C2)C)C(C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)OC)O)N)O
Structure:
CAS RN: 76551-64-9
CAS Name: 3-[[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-heptaene-38-carbo
OPENEYE Name: 3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxo-hexyl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-hep
IUPAC Name: 3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-heptaene-38-carboxy
SYSTEMATIC NAME: 3-[(2R,3S,4S,5S,6R)-4-azanyl-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-18-methyl-19-[7-[4-(methylamino)phenyl]-5-oxidanyl-7-oxidanylidene-heptan-2-yl]-23,27,29,31,33,35,37-heptakis(oxidanyl)-21,25-bis(oxidanylidene)-20,39-dioxabicyclo[33.3.1]nonatriaconta-4
MOLECULAR FORMULA: C59H86N2O19
MOLECULAR WEIGHT: 1127.31614
SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC2CC3C(C(CC(O3)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC(C(C=CC=CC=CC=CC=CC=CC=C2)C)C(C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)O)O)N)O
Structure:
CAS RN: 89445-12-5
CAS Name: 9-(3,5-dihydroxyphenoxy)-2-[9-(3,5-dihydroxyphenoxy)-1,3,6,8-tetrahydroxy-2-dibenzo-p-dioxinyl]dibenzo-p-dioxin-1,3,6,8-tetrol
OPENEYE Name: 9-(3,5-dihydroxyphenoxy)-2-[9-(3,5-dihydroxyphenoxy)-1,3,6,8-tetrahydroxy-dibenzo-p-dioxin-2-yl]dibenzo-p-dioxin-1,3,6,8-tetrol
IUPAC Name: 9-(3,5-dihydroxyphenoxy)-2-[9-(3,5-dihydroxyphenoxy)-1,3,6,8-tetrahydroxydibenzo-p-dioxin-2-yl]dibenzo-p-dioxin-1,3,6,8-tetrol
SYSTEMATIC NAME: 9-[3,5-bis(oxidanyl)phenoxy]-2-[9-[3,5-bis(oxidanyl)phenoxy]-1,3,6,8-tetrakis(oxidanyl)dibenzo-p-dioxin-2-yl]dibenzo-p-dioxin-1,3,6,8-tetrol
MOLECULAR FORMULA: C36H22O18
MOLECULAR WEIGHT: 742.54908
SMILES: C1=C(C=C(C=C1O)OC2=C(C=C(C3=C2OC4=C(C(=C(C=C4O3)O)C5=C(C=C6C(=C5O)OC7=C(O6)C(=CC(=C7OC8=CC(=CC(=C8)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 73932-63-5
CAS Name: 2-chloro-1-[4-(2-phenylethyl)phenyl]ethanone
OPENEYE Name: 2-chloro-1-[4-(2-phenylethyl)phenyl]ethanone
IUPAC Name: 2-chloro-1-[4-(2-phenylethyl)phenyl]ethanone
SYSTEMATIC NAME: 2-chloranyl-1-[4-(2-phenylethyl)phenyl]ethanone
MOLECULAR FORMULA: C16H15ClO
MOLECULAR WEIGHT: 258.7427
SMILES: C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(=O)CCl
Structure:
CAS RN: 7238-55-3
CAS Name: 3,3-dichloro-1,4-diphenyl-2-azetidinone
OPENEYE Name: 3,3-dichloro-1,4-diphenyl-azetidin-2-one
IUPAC Name: 3,3-dichloro-1,4-diphenylazetidin-2-one
SYSTEMATIC NAME: 3,3-bis(chloranyl)-1,4-diphenyl-azetidin-2-one
MOLECULAR FORMULA: C15H11Cl2NO
MOLECULAR WEIGHT: 292.15994
SMILES: C1=CC=C(C=C1)C2C(C(=O)N2C3=CC=CC=C3)(Cl)Cl
Structure:
CAS RN: 5540-82-9
CAS Name: 3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
OPENEYE Name: 3-(4-pentoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one
IUPAC Name: 3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
SYSTEMATIC NAME: 3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
MOLECULAR FORMULA: C15H20N2O2S
MOLECULAR WEIGHT: 292.3965
SMILES: CCCCCOC1=CC=C(C=C1)N2C(=O)CCNC2=S
Structure:
CAS RN: 5596-27-0
CAS Name: 3-(4-butoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
OPENEYE Name: 3-(4-butoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one
IUPAC Name: 3-(4-butoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
SYSTEMATIC NAME: 3-(4-butoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
MOLECULAR FORMULA: C14H18N2O2S
MOLECULAR WEIGHT: 278.36992
SMILES: CCCCOC1=CC=C(C=C1)N2C(=O)CCNC2=S
Structure:
CAS RN: 5540-78-3
CAS Name: 3-(4-propan-2-yloxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
OPENEYE Name: 3-(4-isopropoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one
IUPAC Name: 3-(4-propan-2-yloxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
SYSTEMATIC NAME: 3-(4-propan-2-yloxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
MOLECULAR FORMULA: C13H16N2O2S
MOLECULAR WEIGHT: 264.34334
SMILES: CC(C)OC1=CC=C(C=C1)N2C(=O)CCNC2=S
Structure:
CAS RN: 5540-80-7
CAS Name: 3-(4-propoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
OPENEYE Name: 3-(4-propoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one
IUPAC Name: 3-(4-propoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
SYSTEMATIC NAME: 3-(4-propoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
MOLECULAR FORMULA: C13H16N2O2S
MOLECULAR WEIGHT: 264.34334
SMILES: CCCOC1=CC=C(C=C1)N2C(=O)CCNC2=S
Structure:
CAS RN: 5596-28-1
CAS Name: 3-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
OPENEYE Name: 3-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one
IUPAC Name: 3-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
SYSTEMATIC NAME: 3-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
MOLECULAR FORMULA: C11H12N2O2S
MOLECULAR WEIGHT: 236.29018
SMILES: COC1=CC=C(C=C1)N2C(=O)CCNC2=S
Structure:
CAS RN: 5540-66-9
CAS Name: 3-octyl-2-sulfanylidene-1,3-diazinan-4-one
OPENEYE Name: 3-octyl-2-thioxo-hexahydropyrimidin-4-one
IUPAC Name: 3-octyl-2-sulfanylidene-1,3-diazinan-4-one
SYSTEMATIC NAME: 3-octyl-2-sulfanylidene-1,3-diazinan-4-one
MOLECULAR FORMULA: C12H22N2OS
MOLECULAR WEIGHT: 242.38088
SMILES: CCCCCCCCN1C(=O)CCNC1=S
Structure:
CAS RN: 117627-16-4
CAS Name: 2-[[(2R,3S,4S,5S)-5-(3-acetyl-2-amino-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(3-acetyl-2-amino-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(3-acetyl-2-amino-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-ethanoyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C14H21N2O10P
MOLECULAR WEIGHT: 408.297701
SMILES: CC(=O)C1=CC(C(=O)NC1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117626-87-6
CAS Name: 2-[[(2R,3S,4S,5S)-5-(3-acetyl-2-amino-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(3-acetyl-2-amino-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(3-acetyl-2-amino-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-ethanoyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C14H21N2O10P
MOLECULAR WEIGHT: 408.297701
SMILES: CC(=O)C1=CC(C(=O)NC1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117627-15-3
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-ethenyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-6-oxo-3-vinyl-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-ethenyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-ethenyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C14H21N2O9P
MOLECULAR WEIGHT: 392.298301
SMILES: C=CC1=CC(C(=O)NC1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117626-86-5
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-ethenyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-6-oxo-3-vinyl-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-ethenyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-ethenyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C14H21N2O9P
MOLECULAR WEIGHT: 392.298301
SMILES: C=CC1=CC(C(=O)NC1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117626-85-4
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-methyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-methyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-methyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-methyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C13H21N2O9P
MOLECULAR WEIGHT: 380.287601
SMILES: CC1=CC(C(=O)NC1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117627-14-2
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-methyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-methyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-methyl-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-methyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C13H21N2O9P
MOLECULAR WEIGHT: 380.287601
SMILES: CC1=CC(C(=O)NC1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117626-84-3
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-iodo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-iodo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-iodo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-iodanyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C12H18IN2O9P
MOLECULAR WEIGHT: 492.157551
SMILES: C1=C(C(NC(=O)C1[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O)N)I
Structure:
CAS RN: 117627-13-1
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-iodo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-iodo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-iodo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-iodanyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C12H18IN2O9P
MOLECULAR WEIGHT: 492.157551
SMILES: C1=C(C(NC(=O)C1[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O)N)I
Structure:
CAS RN: 117627-12-0
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-bromo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-bromo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-bromo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-bromanyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C12H18BrN2O9P
MOLECULAR WEIGHT: 445.157081
SMILES: C1=C(C(NC(=O)C1[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O)N)Br
Structure:
CAS RN: 117626-83-2
CAS Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-bromo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-bromo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4S,5S)-5-(2-amino-3-bromo-6-oxo-2,5-dihydro-1H-pyridin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4S,5S)-5-(2-azanyl-3-bromanyl-6-oxidanylidene-2,5-dihydro-1H-pyridin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C12H18BrN2O9P
MOLECULAR WEIGHT: 445.157081
SMILES: C1=C(C(NC(=O)C1[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O)N)Br
Structure:
CAS RN: 117626-82-1
CAS Name: 2-[[(2R,3S,4R,5S)-5-(2-amino-6-oxo-1H-pyrimidin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4R,5S)-5-(2-amino-6-oxo-1H-pyrimidin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4R,5S)-5-(2-amino-6-oxo-1H-pyrimidin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4R,5S)-5-(2-azanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C11H16N3O9P
MOLECULAR WEIGHT: 365.233201
SMILES: C1=C(C(=O)NC(=N1)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117627-20-0
CAS Name: 2-[[(2R,3S,5R)-5-(6-amino-5-bromo-2-oxo-1,6-dihydropyrimidin-3-yl)-3-hydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,5R)-5-(6-amino-5-bromo-2-oxo-1,6-dihydropyrimidin-3-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,5R)-5-(6-amino-5-bromo-2-oxo-1,6-dihydropyrimidin-3-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,5R)-5-(6-azanyl-5-bromanyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl)-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C11H17BrN3O8P
MOLECULAR WEIGHT: 430.145741
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=C(C(NC2=O)N)Br)COP(=O)(CC(=O)O)O)O
Structure:
CAS RN: 117627-17-5
CAS Name: 2-[[(2R,3S,4R,5R)-5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4R,5R)-5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4R,5R)-5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4R,5R)-5-(6-azanyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C11H18N3O9P
MOLECULAR WEIGHT: 367.249081
SMILES: C1=CN(C(=O)NC1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117626-95-6
CAS Name: 2-[[(2R,3S,4R,5R)-5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,4R,5R)-5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,4R,5R)-5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,4R,5R)-5-(6-azanyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C11H18N3O9P
MOLECULAR WEIGHT: 367.249081
SMILES: C1=CN(C(=O)NC1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O)O
Structure:
CAS RN: 117627-18-6
CAS Name: 2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C10H14N5O7P
MOLECULAR WEIGHT: 347.221221
SMILES: C1=NC2=C(N1COCCOP(=O)(CC(=O)O)O)NC(=NC2=O)N
Structure:
CAS RN: 117626-96-7
CAS Name: 2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C10H14N5O7P
MOLECULAR WEIGHT: 347.221221
SMILES: C1=NC2=C(N1COCCOP(=O)(CC(=O)O)O)NC(=NC2=O)N
Structure:
CAS RN: 117627-19-7
CAS Name: 2-[[(2R,3S,5R)-5-(5-ethyl-2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]acetic acid
OPENEYE Name: 2-[[(2R,3S,5R)-5-(5-ethyl-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
IUPAC Name: 2-[[(2R,3S,5R)-5-(5-ethyl-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]acetic acid
SYSTEMATIC NAME: 2-[[(2R,3S,5R)-5-[5-ethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]ethanoic acid
MOLECULAR FORMULA: C13H19N2O9P
MOLECULAR WEIGHT: 378.271721
SMILES: CCC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(CC(=O)O)O)O
Structure:
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