CAS RN: 53939-18-7
CAS Name: sulfuric acid [(6R)-2-(hydroxymethyl)-6-[(3R,5R,7R,8R,9S,10S,12S,13R,14S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptyl] ester
OPENEYE Name: [(6R)-2-(hydroxymethyl)-6-[(3R,5R,7R,8R,9S,10S,12S,13R,14S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptyl] hydrogen sulfate
IUPAC Name: [(6R)-2-(hydroxymethyl)-6-[(3R,5R,7R,8R,9S,10S,12S,13R,14S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptyl] hydrogen sulfate
SYSTEMATIC NAME: [(6R)-6-[(3R,5R,7R,8R,9S,10S,12S,13R,14S)-10,13-dimethyl-3,7,12-tris(oxidanyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-(hydroxymethyl)heptyl] hydrogen sulfate
MOLECULAR FORMULA: C27H48O8S
MOLECULAR WEIGHT: 532.73022
SMILES: C[C@H](CCCC(CO)COS(=O)(=O)O)C1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C
Structure:
CAS RN: 53912-30-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H18NO4+
MOLECULAR WEIGHT: 336.36122
SMILES: CC1=C2C=CC(=C(C2=C[N+]3=C1C4=CC5=C(C=C4CC3)OCO5)O)OC
Structure:
CAS RN: 53452-24-7
CAS Name: 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentyl-2-benzo[b][1,4]benzodioxepincarboxylic acid
OPENEYE Name: 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentyl-benzo[b][1,4]benzodioxepine-2-carboxylic acid
IUPAC Name: 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid
SYSTEMATIC NAME: 3,9,10-tris(oxidanyl)-6-oxidanylidene-7-(2-oxidanylideneheptyl)-1-pentyl-benzo[b][1,4]benzodioxepine-2-carboxylic acid
MOLECULAR FORMULA: C26H30O9
MOLECULAR WEIGHT: 486.511
SMILES: CCCCCC1=C2C(=CC(=C1C(=O)O)O)OC(=O)C3=C(O2)C(=C(C=C3CC(=O)CCCCC)O)O
Structure:
CAS RN: 53899-46-0
CAS Name: 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentyl-2-benzo[b][1,4]benzodioxepincarboxylic acid
OPENEYE Name: 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentyl-benzo[b][1,4]benzodioxepine-2-carboxylic acid
IUPAC Name: 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid
SYSTEMATIC NAME: 3,9,10-tris(oxidanyl)-6-oxidanylidene-7-(2-oxidanylideneheptyl)-1-pentyl-benzo[b][1,4]benzodioxepine-2-carboxylic acid
MOLECULAR FORMULA: C26H30O9
MOLECULAR WEIGHT: 486.511
SMILES: CCCCCC1=C2C(=CC(=C1C(=O)O)O)OC(=O)C3=C(O2)C(=C(C=C3CC(=O)CCCCC)O)O
Structure:
CAS RN: 53891-22-8
CAS Name: disodium 3-amino-5-hydroxynaphthalene-2,7-disulfonate
OPENEYE Name: disodium 3-amino-5-hydroxy-naphthalene-2,7-disulfonate
IUPAC Name: disodium 3-amino-5-hydroxynaphthalene-2,7-disulfonate
SYSTEMATIC NAME: disodium 3-azanyl-5-oxidanyl-naphthalene-2,7-disulfonate
MOLECULAR FORMULA: C10H7NNa2O7S2
MOLECULAR WEIGHT: 363.27462
SMILES: C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)[O-])N)O)S(=O)(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 53861-42-0
CAS Name: ammonia; platinum(2+); chloride; hydrate
OPENEYE Name: ammonia; platinum(2+); chloride; hydrate
IUPAC Name: azane; platinum(2+); chloride; hydrate
SYSTEMATIC NAME: azane; platinum(2+); chloride; hydrate
MOLECULAR FORMULA: ClH8N2OPt+
MOLECULAR WEIGHT: 282.60732
SMILES: N.N.O.[Cl-].[Pt+2]
Structure:
CAS RN: 53848-05-8
CAS Name: 1-methyl-6-oxo-1,3,4,7-tetrahydropyrano[3,4-c]pyridine-5-carboxaldehyde
OPENEYE Name: 1-methyl-6-oxo-1,3,4,7-tetrahydropyrano[3,4-c]pyridine-5-carbaldehyde
IUPAC Name: 1-methyl-6-oxo-1,3,4,7-tetrahydropyrano[3,4-c]pyridine-5-carbaldehyde
SYSTEMATIC NAME: 1-methyl-6-oxidanylidene-1,3,4,7-tetrahydropyrano[3,4-c]pyridine-5-carbaldehyde
MOLECULAR FORMULA: C10H11NO3
MOLECULAR WEIGHT: 193.19924
SMILES: CC1C2=CNC(=O)C(=C2CCO1)C=O
Structure:
CAS RN: 53821-20-8
CAS Name: 11-iodoundecanoic acid ethyl ester
OPENEYE Name: ethyl 11-iodoundecanoate
IUPAC Name: ethyl 11-iodoundecanoate
SYSTEMATIC NAME: ethyl 11-iodanylundecanoate
MOLECULAR FORMULA: C13H25IO2
MOLECULAR WEIGHT: 340.24087
SMILES: CCOC(=O)CCCCCCCCCCI
Structure:
CAS RN: 53808-41-6
CAS Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
OPENEYE Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; isophthalic acid; terephthalic acid
IUPAC Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
MOLECULAR FORMULA: C27H38O13
MOLECULAR WEIGHT: 570.58282
SMILES: CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O
Structure:
CAS RN: 157483-52-8
CAS Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
OPENEYE Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
IUPAC Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
SYSTEMATIC NAME: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
MOLECULAR FORMULA: C19H32O9
MOLECULAR WEIGHT: 404.45198
SMILES: CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC=C1C(=O)O)C(=O)O
Structure:
CAS RN: 53808-40-5
CAS Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
OPENEYE Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
IUPAC Name: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
SYSTEMATIC NAME: 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; terephthalic acid
MOLECULAR FORMULA: C19H32O9
MOLECULAR WEIGHT: 404.45198
SMILES: CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC=C1C(=O)O)C(=O)O
Structure:
CAS RN: 53792-62-4
CAS Name: 3-[4-[(6-chloro-1,3-dimethyl-4-benzimidazol-3-iumyl)azo]-N-ethylanilino]propanenitrile; methyl sulfate
OPENEYE Name: 3-[4-(6-chloro-1,3-dimethyl-benzimidazol-3-ium-4-yl)azo-N-ethyl-anilino]propanenitrile; methyl sulfate
IUPAC Name: 3-[4-[(6-chloro-1,3-dimethylbenzimidazol-3-ium-4-yl)diazenyl]-N-ethylanilino]propanenitrile; methyl sulfate
SYSTEMATIC NAME: 3-[[4-[(6-chloranyl-1,3-dimethyl-benzimidazol-3-ium-4-yl)diazenyl]phenyl]-ethyl-amino]propanenitrile; methyl sulfate
MOLECULAR FORMULA: C21H25ClN6O4S
MOLECULAR WEIGHT: 492.979
SMILES: CCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC(=CC3=C2[N+](=CN3C)C)Cl.COS(=O)(=O)[O-]
Structure:
CAS RN: 53790-93-5
CAS Name: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
OPENEYE Name: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
IUPAC Name: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
SYSTEMATIC NAME: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
MOLECULAR FORMULA: C29H42N2O4
MOLECULAR WEIGHT: 482.65478
SMILES: COC1=C(C=C2C(NCCC2=C1)CCCCCCCC3C4=CC(=C(C=C4CCN3)OC)OC)OC
Structure:
CAS RN: 53749-60-3
CAS Name: (2S)-N-[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[1-[[(2S)-1-amino-4-(methylthio)-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]-2-[[oxo(2-pyrr
OPENEYE Name: (2S)-N-[(1S)-4-amino-1-[[(1S)-1-benzyl-2-[[(1S)-1-benzyl-2-[[2-[[1-[[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamoyl]-3-methyl-butyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]-2-(pyrrolidine-2-carbonylamino)pentane
IUPAC Name: (2S)-N-[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]-2-(pyrrolidi
SYSTEMATIC NAME: (2S)-N-[(2S)-5-azanyl-1-[[(2S)-1-[[(2S)-1-[[2-[[1-[[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phe
MOLECULAR FORMULA: C46H67N11O10S
MOLECULAR WEIGHT: 966.15688
SMILES: CC(C)CC(C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)C3CCCN3
Structure:
CAS RN: 53731-35-4
CAS Name: manganese; phosphonato phosphate
OPENEYE Name: manganese; phosphonato phosphate
IUPAC Name: manganese; phosphonato phosphate
SYSTEMATIC NAME: manganese; phosphonato phosphate
MOLECULAR FORMULA: MnO7P2-4
MOLECULAR WEIGHT: 228.881371
SMILES: [O-]P(=O)([O-])OP(=O)([O-])[O-].[Mn]
Structure:
CAS RN: 93240-94-9
CAS Name: N-[hydroxy(methoxy)phosphinothioyl]acetamide
OPENEYE Name: N-[hydroxy(methoxy)phosphinothioyl]acetamide
IUPAC Name: N-[hydroxy(methoxy)phosphinothioyl]acetamide
SYSTEMATIC NAME: N-[methoxy(oxidanyl)phosphinothioyl]ethanamide
MOLECULAR FORMULA: C3H8NO3PS
MOLECULAR WEIGHT: 169.139281
SMILES: CC(=O)NP(=S)(O)OC
Structure:
CAS RN: 53705-85-4
CAS Name: ammonium N-[methoxy(oxido)phosphinothioyl]acetamide
OPENEYE Name: ammonium N-[methoxy(oxido)phosphinothioyl]acetamide
IUPAC Name: azanium N-[methoxy(oxido)phosphinothioyl]acetamide
SYSTEMATIC NAME: azanium N-[methoxy(oxidanidyl)phosphinothioyl]ethanamide
MOLECULAR FORMULA: C3H11N2O3PS
MOLECULAR WEIGHT: 186.169801
SMILES: CC(=O)NP(=S)([O-])OC.[NH4+]
Structure:
CAS RN: 53681-67-7
CAS Name: 7-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-3-[4-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]-1-benzopyran-4-one
OPENEYE Name: 7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]chromen-4-one
IUPAC Name: 7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
SYSTEMATIC NAME: 7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-[4-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]chromen-4-one
MOLECULAR FORMULA: C27H30O14
MOLECULAR WEIGHT: 578.5187
SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O
Structure:
CAS RN: 53679-54-2
CAS Name: 1,3-diisocyanato-2-methylbenzene; hydrazine
OPENEYE Name: 1,3-diisocyanato-2-methyl-benzene; hydrazine
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; hydrazine
SYSTEMATIC NAME: diazane; 1,3-diisocyanato-2-methyl-benzene
MOLECULAR FORMULA: C9H10N4O2
MOLECULAR WEIGHT: 206.2013
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.NN
Structure:
CAS RN: 53663-70-0
CAS Name: potassium; sodium; N-(4-ethoxyphenyl)acetamide; hydrogen carbonate; N-(4-hydroxyphenyl)acetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid; 1,3,7-trimethylpurine-2,6-dione; bromide
OPENEYE Name: potassium; sodium; citric acid; N-(4-ethoxyphenyl)acetamide; hydrogen carbonate; N-(4-hydroxyphenyl)acetamide; 1,3,7-trimethylpurine-2,6-dione; bromide
IUPAC Name: potassium; sodium; N-(4-ethoxyphenyl)acetamide; hydrogen carbonate; N-(4-hydroxyphenyl)acetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid; 1,3,7-trimethylpurine-2,6-dione; bromide
SYSTEMATIC NAME: potassium; sodium; N-(4-ethoxyphenyl)ethanamide; hydrogen carbonate; N-(4-hydroxyphenyl)ethanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid; 1,3,7-trimethylpurine-2,6-dione; bromide
MOLECULAR FORMULA: C33H41BrKN6NaO16
MOLECULAR WEIGHT: 919.70131
SMILES: CCOC1=CC=C(C=C1)NC(=O)C.CC(=O)NC1=CC=C(C=C1)O.CN1C=NC2=C1C(=O)N(C(=O)N2C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(=O)(O)[O-].[Na+].[K+].[Br-]
Structure:
CAS RN: 53658-58-5
CAS Name: 5,6,7,8-tetrahydro-4H-isoxazolo[4,5-d]azepin-3-one
OPENEYE Name: 5,6,7,8-tetrahydro-4H-isoxazolo[4,5-d]azepin-3-one
IUPAC Name: 5,6,7,8-tetrahydro-4H-[1,2]oxazolo[4,5-d]azepin-3-one
SYSTEMATIC NAME: 5,6,7,8-tetrahydro-4H-[1,2]oxazolo[4,5-d]azepin-3-one
MOLECULAR FORMULA: C7H10N2O2
MOLECULAR WEIGHT: 154.1665
SMILES: C1CNCCC2=C1C(=O)NO2
Structure:
CAS RN: 53657-85-5
CAS Name: 1-methyl-2-nonylbenzene
OPENEYE Name: 1-methyl-2-nonyl-benzene
IUPAC Name: 1-methyl-2-nonylbenzene
SYSTEMATIC NAME: 1-methyl-2-nonyl-benzene
MOLECULAR FORMULA: C16H26
MOLECULAR WEIGHT: 218.37764
SMILES: CCCCCCCCCC1=CC=CC=C1C
Structure:
CAS RN: 53655-17-7
CAS Name: N-[2-[2-(5-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-5-[2-(5-chloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-1-cyclopentenyl]-N-phenylaniline perchlorate
OPENEYE Name: N-[2-[2-(5-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)vinyl]-5-[2-(5-chloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclopenten-1-yl]-N-phenyl-aniline perchlorate
IUPAC Name: N-[2-[2-(5-chloro-3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-5-[2-(5-chloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclopenten-1-yl]-N-phenylaniline perchlorate
SYSTEMATIC NAME: N-[2-[2-(5-chloranyl-3-ethyl-1,3-benzothiazol-3-ium-2-yl)ethenyl]-5-[2-(5-chloranyl-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]cyclopenten-1-yl]-N-phenyl-aniline perchlorate
MOLECULAR FORMULA: C39H34Cl3N3O4S2
MOLECULAR WEIGHT: 779.19396
SMILES: CCN1C2=C(C=CC(=C2)Cl)SC1=CC=C3CCC(=C3N(C4=CC=CC=C4)C5=CC=CC=C5)C=CC6=[N+](C7=C(S6)C=CC(=C7)Cl)CC.[O-]Cl(=O)(=O)=O
Structure:
CAS RN: 53651-67-5
CAS Name: magnesium ethane-1,2-diolate
OPENEYE Name: magnesium ethane-1,2-diolate
IUPAC Name: magnesium ethane-1,2-diolate
SYSTEMATIC NAME: magnesium ethane-1,2-diolate
MOLECULAR FORMULA: C2H4MgO2
MOLECULAR WEIGHT: 84.35696
SMILES: C(C[O-])[O-].[Mg+2]
Structure:
CAS RN: 53643-12-2
CAS Name: N-[(2S,3R,4R,5S,6R)-2-[[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-3-oxanyl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)-3-oxanyl]acetamide
OPENEYE Name: N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-methyl-2-oxo-chromen-7-yl)oxy-tetrahydropyran-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
IUPAC Name: N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-methyl-2-oxochromen-7-yl)oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
SYSTEMATIC NAME: N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-2-(hydroxymethyl)-6-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-4-oxidanyl-oxan-3-yl]oxy-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]ethanamide
MOLECULAR FORMULA: C26H34N2O13
MOLECULAR WEIGHT: 582.55376
SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)NC(=O)C)O)NC(=O)C
Structure:
CAS RN: 53584-33-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H20N2O
MOLECULAR WEIGHT: 244.3321
SMILES: C1CCN2C[C@@H]3C[C@H]([C@@H]2C1)CN4C3=CC=CC4=O
Structure:
CAS RN: 53581-14-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H23NO
MOLECULAR WEIGHT: 293.40272
SMILES: CCCN1CCC2=CC=CC3=C2C1CC4=C3C(=CC=C4)OC
Structure:
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