CAS RN: 28080-54-8
CAS Name: N-methylcarbamic acid (5,6-dihydroxy-1-naphthalenyl) ester
OPENEYE Name: (5,6-dihydroxy-1-naphthyl) N-methylcarbamate
IUPAC Name: (5,6-dihydroxynaphthalen-1-yl) N-methylcarbamate
SYSTEMATIC NAME: [5,6-bis(oxidanyl)naphthalen-1-yl] N-methylcarbamate
MOLECULAR FORMULA: C12H11NO4
MOLECULAR WEIGHT: 233.22004
SMILES: CNC(=O)OC1=CC=CC2=C1C=CC(=C2O)O
Structure:
CAS RN: 2807-37-6
CAS Name: 1,3,6,8-tetra(propan-2-yl)pyrene
OPENEYE Name: 1,3,6,8-tetraisopropylpyrene
IUPAC Name: 1,3,6,8-tetra(propan-2-yl)pyrene
SYSTEMATIC NAME: 1,3,6,8-tetra(propan-2-yl)pyrene
MOLECULAR FORMULA: C28H34
MOLECULAR WEIGHT: 370.56956
SMILES: CC(C)C1=CC(=C2C=CC3=C(C=C(C4=C3C2=C1C=C4)C(C)C)C(C)C)C(C)C
Structure:
CAS RN: 27846-49-7
CAS Name: 1-tetradecylpyridin-1-ium nitrate
OPENEYE Name: 1-tetradecylpyridin-1-ium nitrate
IUPAC Name: 1-tetradecylpyridin-1-ium nitrate
SYSTEMATIC NAME: 1-tetradecylpyridin-1-ium nitrate
MOLECULAR FORMULA: C19H34N2O3
MOLECULAR WEIGHT: 338.48486
SMILES: CCCCCCCCCCCCCC[N+]1=CC=CC=C1.[N+](=O)([O-])[O-]
Structure:
CAS RN: 24148-78-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H34O7
MOLECULAR WEIGHT: 434.52256
SMILES: C[C@@H]1C=C(C(=O)[C@]2([C@H]1C[C@@H]3[C@@]4([C@@H]2[C@@H]([C@H]([C@@H]([C@@H]4CC(=O)O3)C)OC)OC(=O)C)C)C)OC
Structure:
CAS RN: 27844-93-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H34O7
MOLECULAR WEIGHT: 434.52256
SMILES: C[C@@H]1C=C(C(=O)[C@]2([C@H]1C[C@@H]3[C@@]4([C@@H]2[C@@H]([C@H]([C@@H]([C@@H]4CC(=O)O3)C)OC)OC(=O)C)C)C)OC
Structure:
CAS RN: 27699-96-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H36O5
MOLECULAR WEIGHT: 452.58244
SMILES: CC(=O)O[C@@H]1[C@@H]2[C@](C=CC(=O)C2(C)C)([C@H]3CC[C@]4([C@@H](C[C@H]5C4C3([C@H]1O5)C)C6=COC=C6)C)C
Structure:
CAS RN: 2720-75-4
CAS Name: 6,7-dimethoxy-1,3-benzodioxole-5-carboxaldehyde
OPENEYE Name: 6,7-dimethoxy-1,3-benzodioxole-5-carbaldehyde
IUPAC Name: 6,7-dimethoxy-1,3-benzodioxole-5-carbaldehyde
SYSTEMATIC NAME: 6,7-dimethoxy-1,3-benzodioxole-5-carbaldehyde
MOLECULAR FORMULA: C10H10O5
MOLECULAR WEIGHT: 210.1834
SMILES: COC1=C(C2=C(C=C1C=O)OCO2)OC
Structure:
CAS RN: 2671-42-3
CAS Name: acetic acid [(8R,9S,13S,14S,17S)-2,3-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester
OPENEYE Name: [(8R,9S,13S,14S,17S)-2,3-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] acetate
IUPAC Name: [(8R,9S,13S,14S,17S)-2,3-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] acetate
SYSTEMATIC NAME: [(8R,9S,13S,14S,17S)-13-methyl-2,3-bis(oxidanyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ethanoate
MOLECULAR FORMULA: C20H26O4
MOLECULAR WEIGHT: 330.41804
SMILES: CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=C(C=C34)O)O)C
Structure:
CAS RN: 26713-54-2
CAS Name: (13S,14S,17S)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
OPENEYE Name: (13S,14S,17S)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
IUPAC Name: (13S,14S,17S)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
SYSTEMATIC NAME: (13S,14S,17S)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
MOLECULAR FORMULA: C17H18O2
MOLECULAR WEIGHT: 254.32362
SMILES: C1C[C@@H]([C@@H]2[C@H]1C3=C(C(C2)O)C4=CC=CC=C4C=C3)O
Structure:
CAS RN: 26711-20-6
CAS Name: (11R,13S,14S,17R)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
OPENEYE Name: (11R,13S,14S,17R)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
IUPAC Name: (11R,13S,14S,17R)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
SYSTEMATIC NAME: (11R,13S,14S,17R)-12,13,14,15,16,17-hexahydro-11H-cyclopenta[a]phenanthrene-11,17-diol
MOLECULAR FORMULA: C17H18O2
MOLECULAR WEIGHT: 254.32362
SMILES: C1C[C@H]([C@@H]2[C@H]1C3=C([C@@H](C2)O)C4=CC=CC=C4C=C3)O
Structure:
CAS RN: 26710-97-4
CAS Name: (13S,14S,17S)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
OPENEYE Name: (13S,14S,17S)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
IUPAC Name: (13S,14S,17S)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
SYSTEMATIC NAME: (13S,14S,17S)-17-oxidanyl-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1C[C@@H]([C@@H]2[C@H]1C3=C(C(=O)C2)C4=CC=CC=C4C=C3)O
Structure:
CAS RN: 23462-87-5
CAS Name: (13S,14S,17S)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
OPENEYE Name: (13S,14S,17S)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
IUPAC Name: (13S,14S,17S)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
SYSTEMATIC NAME: (13S,14S,17S)-17-oxidanyl-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1C[C@@H]([C@@H]2[C@H]1C3=C(C(=O)C2)C4=CC=CC=C4C=C3)O
Structure:
CAS RN: 26705-20-4
CAS Name: (13S,14S,17R)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
OPENEYE Name: (13S,14S,17R)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
IUPAC Name: (13S,14S,17R)-17-hydroxy-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
SYSTEMATIC NAME: (13S,14S,17R)-17-oxidanyl-12,13,14,15,16,17-hexahydrocyclopenta[a]phenanthren-11-one
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1C[C@H]([C@@H]2[C@H]1C3=C(C(=O)C2)C4=CC=CC=C4C=C3)O
Structure:
CAS RN: 2670-39-5
CAS Name: (11S,13S,14S)-11-hydroxy-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
OPENEYE Name: (11S,13S,14S)-11-hydroxy-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
IUPAC Name: (11S,13S,14S)-11-hydroxy-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: (11S,13S,14S)-11-oxidanyl-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1CC(=O)[C@@H]2[C@H]1C3=C([C@H](C2)O)C4=CC=CC=C4C=C3
Structure:
CAS RN: 26697-35-8
CAS Name: (11R,13S,14S)-11-hydroxy-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
OPENEYE Name: (11R,13S,14S)-11-hydroxy-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
IUPAC Name: (11R,13S,14S)-11-hydroxy-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: (11R,13S,14S)-11-oxidanyl-11,12,13,14,15,16-hexahydrocyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1CC(=O)[C@@H]2[C@H]1C3=C([C@@H](C2)O)C4=CC=CC=C4C=C3
Structure:
CAS RN: 26419-44-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: CC(C)(C=C)[C@@]12[C@@](C[C@@H]3N1C(=O)[C@@H]4CCCN4C3=O)(C5=CC=CC=C5N2)O
Structure:
CAS RN: 261944-46-1
CAS Name: (1R,3S,5S,8R,9S,10R,13R,14S,17R)-1,3,5,14-tetrahydroxy-13-methyl-17-(6-oxo-3-pyranyl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxaldehyde
OPENEYE Name: (1R,3S,5S,8R,9S,10R,13R,14S,17R)-1,3,5,14-tetrahydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
IUPAC Name: (1R,3S,5S,8R,9S,10R,13R,14S,17R)-1,3,5,14-tetrahydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
SYSTEMATIC NAME: (1R,3S,5S,8R,9S,10R,13R,14S,17R)-13-methyl-1,3,5,14-tetrakis(oxidanyl)-17-(6-oxidanylidenepyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
MOLECULAR FORMULA: C24H32O7
MOLECULAR WEIGHT: 432.50668
SMILES: C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=COC(=O)C=C4)O)CC[C@]5([C@@]3([C@@H](C[C@@H](C5)O)O)C=O)O
Structure:
CAS RN: 25946-69-4
CAS Name: 1-[2-[(2-amino-5-carbamoyloxy-3,4-dihydroxy-1-oxopentyl)amino]-2-[5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]-1-oxoethyl]-3-ethenyl-2-azetidinecarboxylic acid
OPENEYE Name: 1-[2-[(2-amino-5-carbamoyloxy-3,4-dihydroxy-pentanoyl)amino]-2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]acetyl]-3-vinyl-azetidine-2-carboxylic acid
IUPAC Name: 1-[2-[(2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl)amino]-2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]acetyl]-3-ethenylazetidine-2-carboxylic acid
SYSTEMATIC NAME: 1-[2-[[5-aminocarbonyloxy-2-azanyl-3,4-bis(oxidanyl)pentanoyl]amino]-2-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]ethanoyl]-3-ethenyl-azetidine-2-carboxylic acid
MOLECULAR FORMULA: C22H30N6O13
MOLECULAR WEIGHT: 586.506
SMILES: C=CC1CN(C1C(=O)O)C(=O)C(C2C(C(C(O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C(C(C(COC(=O)N)O)O)N
Structure:
CAS RN: 25943-52-6
CAS Name: 1-[(13S)-1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl]-2-propanone
OPENEYE Name: 1-[(13S)-1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl]propan-2-one
IUPAC Name: 1-[(13S)-1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl]propan-2-one
SYSTEMATIC NAME: 1-[(13S)-1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl]propan-2-one
MOLECULAR FORMULA: C24H23NO5
MOLECULAR WEIGHT: 405.44312
SMILES: CC(=O)C[C@H]1C2=C(C=CC(=C2OC)OC)C3=C(N1C)C4=CC5=C(C=C4C=C3)OCO5
Structure:
CAS RN: 25843-75-8
CAS Name: (3S,4S,5R)-5-hydroxy-4-[(3S)-3-hydroxy-3-[(2S,3R,5S,9R,10R,13R,17S)-2,3,5,14-tetrahydroxy-10,13-dimethyl-6-oxo-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]butyl]-3-methyl-2-oxanone
OPENEYE Name: (3S,4S,5R)-5-hydroxy-4-[(3S)-3-hydroxy-3-[(2S,3R,5S,9R,10R,13R,17S)-2,3,5,14-tetrahydroxy-10,13-dimethyl-6-oxo-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]butyl]-3-methyl-tetrahydropyran-2-one
IUPAC Name: (3S,4S,5R)-5-hydroxy-4-[(3S)-3-hydroxy-3-[(2S,3R,5S,9R,10R,13R,17S)-2,3,5,14-tetrahydroxy-10,13-dimethyl-6-oxo-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]butyl]-3-methyloxan-2-one
SYSTEMATIC NAME: (3S,4S,5R)-4-[(3S)-3-[(2S,3R,5S,9R,10R,13R,17S)-10,13-dimethyl-2,3,5,14-tetrakis(oxidanyl)-6-oxidanylidene-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-3-oxidanyl-butyl]-3-methyl-5-oxidanyl-oxan-2-one
MOLECULAR FORMULA: C29H44O9
MOLECULAR WEIGHT: 536.65426
SMILES: C[C@H]1[C@@H]([C@H](COC1=O)O)CC[C@@](C)([C@H]2CCC3([C@@]2(CC[C@H]4C3=CC(=O)[C@]5([C@@]4(C[C@@H]([C@@H](C5)O)O)C)O)C)O)O
Structure:
CAS RN: 32328-42-0
CAS Name: (3S,4S,5R)-5-hydroxy-4-[(3S)-3-hydroxy-3-[(2S,3R,5S,9R,10R,13R,17S)-2,3,5,14-tetrahydroxy-10,13-dimethyl-6-oxo-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]butyl]-3-methyl-2-oxanone
OPENEYE Name: (3S,4S,5R)-5-hydroxy-4-[(3S)-3-hydroxy-3-[(2S,3R,5S,9R,10R,13R,17S)-2,3,5,14-tetrahydroxy-10,13-dimethyl-6-oxo-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]butyl]-3-methyl-tetrahydropyran-2-one
IUPAC Name: (3S,4S,5R)-5-hydroxy-4-[(3S)-3-hydroxy-3-[(2S,3R,5S,9R,10R,13R,17S)-2,3,5,14-tetrahydroxy-10,13-dimethyl-6-oxo-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]butyl]-3-methyloxan-2-one
SYSTEMATIC NAME: (3S,4S,5R)-4-[(3S)-3-[(2S,3R,5S,9R,10R,13R,17S)-10,13-dimethyl-2,3,5,14-tetrakis(oxidanyl)-6-oxidanylidene-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-3-oxidanyl-butyl]-3-methyl-5-oxidanyl-oxan-2-one
MOLECULAR FORMULA: C29H44O9
MOLECULAR WEIGHT: 536.65426
SMILES: C[C@H]1[C@@H]([C@H](COC1=O)O)CC[C@@](C)([C@H]2CCC3([C@@]2(CC[C@H]4C3=CC(=O)[C@]5([C@@]4(C[C@@H]([C@@H](C5)O)O)C)O)C)O)O
Structure:
CAS RN: 25787-51-3
CAS Name: (1S,2R,4R)-2-hydroxy-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanone
OPENEYE Name: (1R,3R,4S)-3-hydroxy-1,7,7-trimethyl-norbornan-2-one
IUPAC Name: (1S,2R,4R)-2-hydroxy-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one
SYSTEMATIC NAME: (1S,2R,4R)-4,7,7-trimethyl-2-oxidanyl-bicyclo[2.2.1]heptan-3-one
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: C[C@@]12CC[C@@H](C1(C)C)[C@H](C2=O)O
Structure:
CAS RN: 79089-47-7
CAS Name: (4R)-4-hydroxy-2-pyrrolidinone
OPENEYE Name: (4R)-4-hydroxypyrrolidin-2-one
IUPAC Name: (4R)-4-hydroxypyrrolidin-2-one
SYSTEMATIC NAME: (4R)-4-oxidanylpyrrolidin-2-one
MOLECULAR FORMULA: C4H7NO2
MOLECULAR WEIGHT: 101.10388
SMILES: C1[C@H](CNC1=O)O
Structure:
CAS RN: 22677-21-0
CAS Name: (4R)-4-hydroxy-2-pyrrolidinone
OPENEYE Name: (4R)-4-hydroxypyrrolidin-2-one
IUPAC Name: (4R)-4-hydroxypyrrolidin-2-one
SYSTEMATIC NAME: (4R)-4-oxidanylpyrrolidin-2-one
MOLECULAR FORMULA: C4H7NO2
MOLECULAR WEIGHT: 101.10388
SMILES: C1[C@H](CNC1=O)O
Structure:
CAS RN: 25649-03-0
CAS Name: 2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-[4-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]acetonitrile
OPENEYE Name: 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]acetonitrile
IUPAC Name: 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetonitrile
SYSTEMATIC NAME: 2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2-[4-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]ethanenitrile
MOLECULAR FORMULA: C20H27NO12
MOLECULAR WEIGHT: 473.42788
SMILES: C1=CC(=CC=C1C(C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
Structure:
CAS RN: 22660-96-4
CAS Name: 2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-[4-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]acetonitrile
OPENEYE Name: 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]acetonitrile
IUPAC Name: 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetonitrile
SYSTEMATIC NAME: 2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2-[4-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]ethanenitrile
MOLECULAR FORMULA: C20H27NO12
MOLECULAR WEIGHT: 473.42788
SMILES: C1=CC(=CC=C1C(C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
Structure:
CAS RN: 25637-52-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H46O4
MOLECULAR WEIGHT: 470.68384
SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5C46CC[C@](C5(C)C)(OC6)O)C)[C@@H]2[C@H]1C)C)C(=O)O
Structure:
CAS RN: 22541-87-3
CAS Name: molybdenum(2+)
OPENEYE Name: molybdenum(2+)
IUPAC Name: molybdenum(2+)
SYSTEMATIC NAME: molybdenum(2+)
MOLECULAR FORMULA: Mo+2
MOLECULAR WEIGHT: 95.94
SMILES: [Mo+2]
Structure:
CAS RN: 22541-60-2
CAS Name: rhodium(2+)
OPENEYE Name: rhodium(2+)
IUPAC Name: rhodium(2+)
SYSTEMATIC NAME: rhodium(2+)
MOLECULAR FORMULA: Rh+2
MOLECULAR WEIGHT: 102.9055
SMILES: [Rh+2]
Structure:
CAS RN: 22541-29-3
CAS Name: osmium(8+)
OPENEYE Name: osmium(8+)
IUPAC Name: osmium(8+)
SYSTEMATIC NAME: osmium(8+)
MOLECULAR FORMULA: Os+8
MOLECULAR WEIGHT: 190.23
SMILES: [Os+8]
Structure:
CAS RN: 22541-24-8
CAS Name: lutetium(3+)
OPENEYE Name: lutetium(3+)
IUPAC Name: lutetium(3+)
SYSTEMATIC NAME: lutetium(3+)
MOLECULAR FORMULA: Lu+3
MOLECULAR WEIGHT: 174.967
SMILES: [Lu+3]
Structure:
CAS RN: 22541-23-7
CAS Name: thulium(3+)
OPENEYE Name: thulium(3+)
IUPAC Name: thulium(3+)
SYSTEMATIC NAME: thulium(3+)
MOLECULAR FORMULA: Tm+3
MOLECULAR WEIGHT: 168.93421
SMILES: [Tm+3]
Structure:
CAS RN: 22541-22-6
CAS Name: holmium(3+)
OPENEYE Name: holmium(3+)
IUPAC Name: holmium(3+)
SYSTEMATIC NAME: holmium(3+)
MOLECULAR FORMULA: Ho+3
MOLECULAR WEIGHT: 164.93032
SMILES: [Ho+3]
Structure:
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