Chem
J-GLOBAL ID：200907017767638612   Nikkaji number：J1.576.295K

(S)-2-(tert-Butoxycarbonylamino)-4-[[(2R)-3α-hydroxy-4α,5α-bis(benzyloxy)tetrahydro-2H-pyran-2α-yl]methyl]-4-pentenoic acid methyl ester

(S)-2-(tert-ブトキシカルボニルアミノ)-4-[[(2R)-3α-ヒドロキシ-4α,5α-ビス(ベンジルオキシ)テトラヒドロ-2H-ピラン-2α-イル]メチル]-4-ペンテン酸メチル
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： C31H41NO8
Molecular formula furigana： C31-H41-N-O8
Molecular weight： 555.668
InChI： InChI=1S/C31H41NO8/c1-21(16-24(29(34)36-5)32-30(35)40-31(2,3)4)17-25-27(33)28(39-19-23-14-10-7-11-15-23)26(20-38-25)37-18-22-12-8-6-9-13-22/h6-15,24-28,33H,1,16-20H2,2-5H3,(H,32,35)/t24-,25+,26+,27-,28+/m0/s1
InChI key： BEPCVCFROMYIRW-RKJAVHAZSA-N
SMILES： COC(=O)[C@H](CC(=C)C[C@H]1OC[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1O)NC(=O)OC(C)(C)C
Systematic name  (3)：
  • (S)-2-(tert-ブトキシカルボニルアミノ)-4-[[(2R)-3α-ヒドロキシ-4α,5α-ビス(ベンジルオキシ)テトラヒドロ-2H-ピラン-2α-イル]メチル]-4-ペンテン酸メチル
  • メチル (2S)-4-{[(2R,3S,4S,5R)-4,5-ビス(ベンジルオキシ)-3-ヒドロキシオキサン-2-イル]メチル}-2-{[(tert-ブトキシ)カルボニル]アミノ}ペンタ-4-エノアート
  • methyl (2S)-4-{[(2R,3S,4S,5R)-4,5-bis(benzyloxy)-3-hydroxyoxan-2-yl]methyl}-2-{[(tert-butoxy)carbonyl]amino}pent-4-enoate
Other name (1)：
  • (S)-2-(tert-Butoxycarbonylamino)-4-[[(2R)-3α-hydroxy-4α,5α-bis(benzyloxy)tetrahydro-2H-pyran-2α-yl]methyl]-4-pentenoic acid methyl ester
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