Chem
J-GLOBAL ID：200907071878186847   Nikkaji number：J2.314.856K

2-[(S)-(tert-Butoxycarbonylamino)(2-furanyl)methyl]malonic acid dibenzyl ester

2-[(S)-(tert-ブトキシカルボニルアミノ)(2-フラニル)メチル]マロン酸ジベンジル
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： C27H29NO7
Molecular formula furigana： C27-H29-N-O7
Molecular weight： 479.529
InChI： InChI=1S/C27H29NO7/c1-27(2,3)35-26(31)28-23(21-15-10-16-32-21)22(24(29)33-17-19-11-6-4-7-12-19)25(30)34-18-20-13-8-5-9-14-20/h4-16,22-23H,17-18H2,1-3H3,(H,28,31)/t23-/m1/s1
InChI key： ZLGHFMPQPRVUDU-HSZRJFAPSA-N
SMILES： CC(C)(C)OC(=O)N[C@@H](C(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1)c1ccco1
Systematic name  (3)：
  • 2-[(S)-(tert-ブトキシカルボニルアミノ)(2-フラニル)メチル]マロン酸ジベンジル
  • 1,3-ジベンジル 2-[(S)-{[(tert-ブトキシ)カルボニル]アミノ}(フラン-2-イル)メチル]プロパンジオアート
  • 1,3-dibenzyl 2-[(S)-{[(tert-butoxy)carbonyl]amino}(furan-2-yl)methyl]propanedioate
Other name (1)：
  • 2-[(S)-(tert-Butoxycarbonylamino)(2-furanyl)methyl]malonic acid dibenzyl ester
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