Chem
J-GLOBAL ID：200907055372937865   Nikkaji number：J764.468J

N-(tert-Butoxycarbonyl)-β-alanine 4-[2,3-bis(benzyloxycarbonyl)guanidino]phenyl ester

N-(tert-ブトキシカルボニル)-β-アラニン4-[2,3-ビス(ベンジルオキシカルボニル)グアニジノ]フェニル
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： C31H34N4O8
Molecular formula furigana： C31-H34-N4-O8
Molecular weight： 590.633
InChI： InChI=1S/C31H34N4O8/c1-31(2,3)43-28(37)32-19-18-26(36)42-25-16-14-24(15-17-25)33-27(34-29(38)40-20-22-10-6-4-7-11-22)35-30(39)41-21-23-12-8-5-9-13-23/h4-17H,18-21H2,1-3H3,(H,32,37)(H2,33,34,35,38,39)
InChI key： KABWDIZECFLNCQ-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)NCCC(=O)Oc1ccc(NC(=NC(=O)OCc2ccccc2)NC(=O)OCc2ccccc2)cc1
Systematic name  (3)：
  • N-(tert-ブトキシカルボニル)-β-アラニン4-[2,3-ビス(ベンジルオキシカルボニル)グアニジノ]フェニル
  • 4-[({[(ベンジルオキシ)カルボニル]アミノ}({[(ベンジルオキシ)カルボニル]イミノ})メチル)アミノ]フェニル 3-{[(tert-ブトキシ)カルボニル]アミノ}プロパノアート
  • 4-[({[(benzyloxy)carbonyl]amino}({[(benzyloxy)carbonyl]imino})methyl)amino]phenyl 3-{[(tert-butoxy)carbonyl]amino}propanoate
Other name (1)：
  • N-(tert-Butoxycarbonyl)-β-alanine 4-[2,3-bis(benzyloxycarbonyl)guanidino]phenyl ester
Thsaurus map：
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