Chem
J-GLOBAL ID：201407008649653527
Nikkaji number：J3.280.328H
S-[2-[[4-[[4-[[2-(Tritylamino)acetyl]amino]phenyl]azo]phenyl]amino]-2-oxoethyl]-N-acetyl-L-cysteine
S-[2-[[4-[[4-[[2-(トリチルアミノ)アセチル]アミノ]フェニル]アゾ]フェニル]アミノ]-2-オキソエチル]-N-アセチル-L-システイン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C40H38N6O5S
Molecular formula furigana： C40-H38-N6-O5-S
Molecular weight： 714.840
InChI：
InChI=1S/C40H38N6O5S/c1-28(47)42-36(39(50)51)26-52-27-38(49)44-33-19-23-35(24-20-33)46-45-34-21-17-32(18-22-34)43-37(48)25-41-40(29-11-5-2-6-12-29,30-13-7-3-8-14-30)31-15-9-4-10-16-31/h2-24,36,41H,25-27H2,1H3,(H,42,47)(H,43,48)(H,44,49)(H,50,51)/t36-/m0/s1
InChI key：
ZTMWPJFLBNTERP-BHVANESWSA-N
SMILES：
CC(=O)N[C@@H](CSCC(=O)Nc1ccc(cc1)N=Nc1ccc(NC(=O)CNC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)C(=O)O
Systematic name (3)：
- S-[2-[[4-[[4-[[2-(トリチルアミノ)アセチル]アミノ]フェニル]アゾ]フェニル]アミノ]-2-オキソエチル]-N-アセチル-L-システイン
- (2R)-2-アセトアミド-3-{[({4-[2-(4-{2-[(トリフェニルメチル)アミノ]アセトアミド}フェニル)ジアゼン-1-イル]フェニル}カルバモイル)メチル]スルファニル}プロパン酸
- (2R)-2-acetamido-3-{[({4-[2-(4-{2-[(triphenylmethyl)amino]acetamido}phenyl)diazen-1-yl]phenyl}carbamoyl)methyl]sulfanyl}propanoic acid
- S-[2-[[4-[[4-[[2-(Tritylamino)acetyl]amino]phenyl]azo]phenyl]amino]-2-oxoethyl]-N-acetyl-L-cysteine
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