Chem
J-GLOBAL ID：200907030547700968   Nikkaji number：J455.401I

(2R,4S,5S)-N-Isobutyl-5-[N-[N-benzyloxycarbonyl-3-(1-naphthyl)-L-alanyl]-L-norleucyl]amino-2-propyl-4-hydroxy-7-methyloctanamide

(2R,4S,5S)-N-イソブチル-5-[N-[N-ベンジルオキシカルボニル-3-(1-ナフチル)-L-アラニル]-L-ノルロイシル]アミノ-2-プロピル-4-ヒドロキシ-7-メチルオクタンアミド
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： C43H62N4O6
Molecular formula furigana： C43-H62-N4-O6
Molecular weight： 730.991
InChI： InChI=1S/C43H62N4O6/c1-7-9-23-36(42(51)47(27-30(5)6)38(24-29(3)4)39(48)26-34(16-8-2)40(44)49)45-41(50)37(46-43(52)53-28-31-17-11-10-12-18-31)25-33-21-15-20-32-19-13-14-22-35(32)33/h10-15,17-22,29-30,34,36-39,48H,7-9,16,23-28H2,1-6H3,(H2,44,49)(H,45,50)(H,46,52)/t34-,36+,37+,38+,39+/m1/s1
InChI key： FOLNGABTQPCCJS-DOWKINRCSA-N
SMILES： CCCC[C@H](NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)C(=O)N(CC(C)C)[C@@H](CC(C)C)[C@@H](O)C[C@@H](CCC)C(=O)N
Systematic name  (3)：
  • (2R,4S,5S)-N-イソブチル-5-[N-[N-ベンジルオキシカルボニル-3-(1-ナフチル)-L-アラニル]-L-ノルロイシル]アミノ-2-プロピル-4-ヒドロキシ-7-メチルオクタンアミド
  • ベンジル N-[(1S)-1-{[(1S)-1-{[(1R,3S,4S)-1-カルバモイル-3-ヒドロキシ-6-メチル-1-プロピルヘプタン-4-イル](2-メチルプロピル)カルバモイル}ペンチル]カルバモイル}-2-(ナフタレン-1-イル)エチル]カルバマート
  • benzyl N-[(1S)-1-{[(1S)-1-{[(1R,3S,4S)-1-carbamoyl-3-hydroxy-6-methyl-1-propylheptan-4-yl](2-methylpropyl)carbamoyl}pentyl]carbamoyl}-2-(naphthalen-1-yl)ethyl]carbamate
Other name (1)：
  • (2R,4S,5S)-N-Isobutyl-5-[N-[N-benzyloxycarbonyl-3-(1-naphthyl)-L-alanyl]-L-norleucyl]amino-2-propyl-4-hydroxy-7-methyloctanamide
Thsaurus map：
Thesaurus Map

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