Chem
J-GLOBAL ID：201407067595108508
Nikkaji number：J3.275.877K
O-[[4-[(Phenylthio)methyl]-5-(4-methoxyphenyl)-3-furyl]methyl]-N-(tert-butyloxycarbonyl)-L-tyrosine methyl ester
O-[[4-[(フェニルチオ)メチル]-5-(4-メトキシフェニル)-3-フリル]メチル]-N-(tert-ブチルオキシカルボニル)-L-チロシンメチル
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： C34H37NO7S
Molecular formula furigana： C34-H37-N-O7-S
Molecular weight： 603.730
InChI：
InChI=1S/C34H37NO7S/c1-34(2,3)42-33(37)35-30(32(36)39-5)19-23-11-15-27(16-12-23)40-20-25-21-41-31(24-13-17-26(38-4)18-14-24)29(25)22-43-28-9-7-6-8-10-28/h6-18,21,30H,19-20,22H2,1-5H3,(H,35,37)/t30-/m0/s1
InChI key：
USBQNSAGQFKQDV-PMERELPUSA-N
SMILES：
COC(=O)[C@H](Cc1ccc(OCc2coc(c2CSc2ccccc2)c2ccc(OC)cc2)cc1)NC(=O)OC(C)(C)C
Systematic name (3)：
- O-[[4-[(フェニルチオ)メチル]-5-(4-メトキシフェニル)-3-フリル]メチル]-N-(tert-ブチルオキシカルボニル)-L-チロシンメチル
- メチル (2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}-3-(4-{[5-(4-メトキシフェニル)-4-[(フェニルスルファニル)メチル]フラン-3-イル]メトキシ}フェニル)プロパノアート
- methyl (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(4-{[5-(4-methoxyphenyl)-4-[(phenylsulfanyl)methyl]furan-3-yl]methoxy}phenyl)propanoate
- O-[[4-[(Phenylthio)methyl]-5-(4-methoxyphenyl)-3-furyl]methyl]-N-(tert-butyloxycarbonyl)-L-tyrosine methyl ester
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