Chem
J-GLOBAL ID:200907003431228261   Nikkaji number:J1.709.585D

(2E,4R,5R)-4-Acetoxy-5-(tert-butoxycarbonylamino)-9-(2-chlorobenzyloxycarbonylamino)-2-nonenoic acid tert-butyl ester

(2E,4R,5R)-4-アセトキシ-5-(tert-ブトキシカルボニルアミノ)-9-(2-クロロベンジルオキシカルボニルアミノ)-2-ノネン酸tert-ブチル
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: C28H41ClN2O8
Molecular formula furigana: C28-H41-CL-N2-O8
Molecular weight: 569.090
InChI: InChI=1S/C28H41ClN2O8/c1-19(32)37-23(15-16-24(33)38-27(2,3)4)22(31-26(35)39-28(5,6)7)14-10-11-17-30-25(34)36-18-20-12-8-9-13-21(20)29/h8-9,12-13,15-16,22-23H,10-11,14,17-18H2,1-7H3,(H,30,34)(H,31,35)/b16-15+/t22-,23-/m1/s1
InChI key: BZWQAWUAPXUVTK-LBBXHWODSA-N
SMILES: CC(=O)O[C@H](/C=C/C(=O)OC(C)(C)C)[C@@H](CCCCNC(=O)OCc1ccccc1Cl)NC(=O)OC(C)(C)C
Systematic name  (3):
  • (2E,4R,5R)-4-アセトキシ-5-(tert-ブトキシカルボニルアミノ)-9-(2-クロロベンジルオキシカルボニルアミノ)-2-ノネン酸tert-ブチル
  • tert-ブチル (2E,4R,5R)-4-(アセチルオキシ)-5-{[(tert-ブトキシ)カルボニル]アミノ}-9-({[(2-クロロフェニル)メトキシ]カルボニル}アミノ)ノナ-2-エノアート
  • tert-butyl (2E,4R,5R)-4-(acetyloxy)-5-{[(tert-butoxy)carbonyl]amino}-9-({[(2-chlorophenyl)methoxy]carbonyl}amino)non-2-enoate
Other name (1):
  • (2E,4R,5R)-4-Acetoxy-5-(tert-butoxycarbonylamino)-9-(2-chlorobenzyloxycarbonylamino)-2-nonenoic acid tert-butyl ester
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