Chem
J-GLOBAL ID:200907089994088379
Nikkaji number:J2.496.954A
N-(4-Methoxybenzyl)-N-[(1R)-1-[(R)-1-(benzyloxycarbonylamino)-2-(tert-butyldiphenylsiloxy)ethyl]-5-[methylthio(4-methoxyphenylsulfonylimino)methylamino]-2-pentynyl]hydroxylamine
N-(4-メトキシベンジル)-N-[(1R)-1-[(R)-1-(ベンジルオキシカルボニルアミノ)-2-(tert-ブチルジフェニルシロキシ)エチル]-5-[メチルチオ(4-メトキシフェニルスルホニルイミノ)メチルアミノ]-2-ペンチニル]ヒドロキシルアミン
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Substance type:
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
Molecular formula:
C48 H56 N4 O8 S2 Si
Molecular formula furigana:
C48-H56-N4-O8-S2-SI
Molecular weight:
909.200
InChI:
InChI=1S/C48H56N4O8S2Si/c1-48(2,3)63(42-20-12-8-13-21-42,43-22-14-9-15-23-43)60-36-44(50-47(53)59-35-38-18-10-7-11-19-38)45(52(54)34-37-25-27-39(57-4)28-26-37)24-16-17-33-49-46(61-6)51-62(55,56)41-31-29-40(58-5)30-32-41/h7-15,18-23,25-32,44-45,54H,17,33-36H2,1-6H3,(H,49,51)(H,50,53)/t44-,45+/m0/s1
InChI key:
NITKCFRLHRUELH-YWPUXERESA-N
SMILES:
COc1ccc(CN(O)[C@H](C#CCCNC(=NS(=O)(=O)c2ccc(OC)cc2)SC)[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)NC(=O)OCc2ccccc2)cc1
Systematic name (3):
N-(4-メトキシベンジル)-N-[(1R)-1-[(R)-1-(ベンジルオキシカルボニルアミノ)-2-(tert-ブチルジフェニルシロキシ)エチル]-5-[メチルチオ(4-メトキシフェニルスルホニルイミノ)メチルアミノ]-2-ペンチニル]ヒドロキシルアミン
ベンジル N-[(2R,3R)-1-[(tert-ブチルジフェニルシリル)オキシ]-3-{ヒドロキシ[(4-メトキシフェニル)メチル]アミノ}-7-({[(4-メトキシベンゼンスルホニル)イミノ](メチルスルファニル)メチル}アミノ)ヘプタ-4-イン-2-イル]カルバマート
benzyl N-[(2R,3R)-1-[(tert-butyldiphenylsilyl)oxy]-3-{hydroxy[(4-methoxyphenyl)methyl]amino}-7-({[(4-methoxybenzenesulfonyl)imino](methylsulfanyl)methyl}amino)hept-4-yn-2-yl]carbamate
Other name (1):
N-(4-Methoxybenzyl)-N-[(1R)-1-[(R)-1-(benzyloxycarbonylamino)-2-(tert-butyldiphenylsiloxy)ethyl]-5-[methylthio(4-methoxyphenylsulfonylimino)methylamino]-2-pentynyl]hydroxylamine
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