3alpha-N-(N-tert-butyloxycarbonyl-O-benzyl-L-tyrosyl)aminocholestane

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基本情報

標準SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4C[C@H](NC(=O)[C@H](Cc5ccc(OCc6ccccc6)cc5)NC(=O)OC(C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey: MFLAFOORSZPRAB-RGNCYDDUSA-N
分子式: C48H72N2O4
平均分子量: 741.1 g/mol
単同位体質量: 740.54920878

優先名称: 3alpha-N-(N-tert-butyloxycarbonyl-O-benzyl-L-tyrosyl)aminocholestane
IUPAC: tert-butyl N-[(2S)-1-[[(3R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]amino]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamate

SCHEMBL7996353MFLAFOORSZPRAB-RGNCYDDUSA-N3alpha-N-(N-tert-butyloxycarbonyl-O-benzyl-L-tyrosyl)aminocholestane

読み込み中…

標準SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4C[C@H](NC(=O)[C@H](Cc5ccc(OCc6ccccc6)cc5)NC(=O)OC(C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey: MFLAFOORSZPRAB-RGNCYDDUSA-N
分子式: C48H72N2O4
平均分子量: 741.1 g/mol
単同位体質量: 740.54920878

優先名称: 3alpha-N-(N-tert-butyloxycarbonyl-O-benzyl-L-tyrosyl)aminocholestane
IUPAC: tert-butyl N-[(2S)-1-[[(3R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]amino]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamate

SCHEMBL7996353MFLAFOORSZPRAB-RGNCYDDUSA-N3alpha-N-(N-tert-butyloxycarbonyl-O-benzyl-L-tyrosyl)aminocholestane

読み込み中…