Chem
J-GLOBAL ID：200907096404510220   Nikkaji number：J921.668E

N-[(1S,2S,4S)-1-Benzyl-2-hydroxy-4-[[N-[(5-methoxy-2-pyridinylmethoxy)carbonyl]-L-valyl]amino]-5-phenylpentyl]carbamic acid 3-pyridinylmethyl ester

N-[(1S,2S,4S)-1-ベンジル-2-ヒドロキシ-4-[[N-[(5-メトキシ-2-ピリジニルメトキシ)カルボニル]-L-バリル]アミノ]-5-フェニルペンチル]カルバミン酸3-ピリジニルメチル
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： C38H45N5O7
Molecular formula furigana： C38-H45-N5-O7
Molecular weight： 683.806
InChI： InChI=1S/C38H45N5O7/c1-26(2)35(43-38(47)50-25-30-16-17-32(48-3)23-40-30)36(45)41-31(19-27-11-6-4-7-12-27)21-34(44)33(20-28-13-8-5-9-14-28)42-37(46)49-24-29-15-10-18-39-22-29/h4-18,22-23,26,31,33-35,44H,19-21,24-25H2,1-3H3,(H,41,45)(H,42,46)(H,43,47)/t31-,33-,34-,35-/m0/s1
InChI key： WREBNBJWQDJRGR-OZFLXDGESA-N
SMILES： COc1ccc(COC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cccnc2)Cc2ccccc2)nc1
Systematic name  (3)：
  • N-[(1S,2S,4S)-1-ベンジル-2-ヒドロキシ-4-[[N-[(5-メトキシ-2-ピリジニルメトキシ)カルボニル]-L-バリル]アミノ]-5-フェニルペンチル]カルバミン酸3-ピリジニルメチル
  • (ピリジン-3-イル)メチル N-[(2S,3S,5S)-3-ヒドロキシ-5-[(2S)-2-({[(5-メトキシピリジン-2-イル)メトキシ]カルボニル}アミノ)-3-メチルブタンアミド]-1,6-ジフェニルヘキサン-2-イル]カルバマート
  • (pyridin-3-yl)methyl N-[(2S,3S,5S)-3-hydroxy-5-[(2S)-2-({[(5-methoxypyridin-2-yl)methoxy]carbonyl}amino)-3-methylbutanamido]-1,6-diphenylhexan-2-yl]carbamate
Other name (1)：
  • N-[(1S,2S,4S)-1-Benzyl-2-hydroxy-4-[[N-[(5-methoxy-2-pyridinylmethoxy)carbonyl]-L-valyl]amino]-5-phenylpentyl]carbamic acid 3-pyridinylmethyl ester
Thsaurus map：
Thesaurus Map

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