Chem
J-GLOBAL ID：200907032544896937   Nikkaji number：J2.128.189A

(3S)-N-Benzyl-3-[(benzyloxycarbonyl)amino]-5-[1-methyl-2,3-bis(tert-butyloxycarbonyl)guanidino]pentanamide

(3S)-N-ベンジル-3-[(ベンジルオキシカルボニル)アミノ]-5-[1-メチル-2,3-ビス(tert-ブチルオキシカルボニル)グアニジノ]ペンタンアミド
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： C32H45N5O7
Molecular formula furigana： C32-H45-N5-O7
Molecular weight： 611.740
InChI： InChI=1S/C32H45N5O7/c1-31(2,3)43-29(40)35-27(36-30(41)44-32(4,5)6)37(7)19-18-25(20-26(38)33-21-23-14-10-8-11-15-23)34-28(39)42-22-24-16-12-9-13-17-24/h8-17,25H,18-22H2,1-7H3,(H,33,38)(H,34,39)(H,35,36,40,41)/t25-/m0/s1
InChI key： XBALADRWNPXFMX-VWLOTQADSA-N
SMILES： CN(CC[C@@H](CC(=O)NCc1ccccc1)NC(=O)OCc1ccccc1)C(=NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
Systematic name  (3)：
  • (3S)-N-ベンジル-3-[(ベンジルオキシカルボニル)アミノ]-5-[1-メチル-2,3-ビス(tert-ブチルオキシカルボニル)グアニジノ]ペンタンアミド
  • ベンジル N-[(2S)-1-(ベンジルカルバモイル)-4-[({[(tert-ブトキシ)カルボニル]アミノ}({[(tert-ブトキシ)カルボニル]イミノ})メチル)(メチル)アミノ]ブタン-2-イル]カルバマート
  • benzyl N-[(2S)-1-(benzylcarbamoyl)-4-[({[(tert-butoxy)carbonyl]amino}({[(tert-butoxy)carbonyl]imino})methyl)(methyl)amino]butan-2-yl]carbamate
Other name (1)：
  • (3S)-N-Benzyl-3-[(benzyloxycarbonyl)amino]-5-[1-methyl-2,3-bis(tert-butyloxycarbonyl)guanidino]pentanamide
Thsaurus map：
Thesaurus Map

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