Chem
J-GLOBAL ID:200907026876560592   Nikkaji number:J2.723.754A

(E)-3-Phenyl-4-(2-O,3-O,4-O,6-O-tetrabenzyl-α-D-mannopyranosyl)-2-butenoic acid methyl ester

(E)-3-フェニル-4-(2-O,3-O,4-O,6-O-テトラベンジル-α-D-マンノピラノシル)-2-ブテン酸メチル
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: C45H46O7
Molecular formula furigana: C45-H46-O7
Molecular weight: 698.856
InChI: InChI=1S/C45H46O7/c1-47-42(46)28-39(38-25-15-6-16-26-38)27-40-43(49-30-35-19-9-3-10-20-35)45(51-32-37-23-13-5-14-24-37)44(50-31-36-21-11-4-12-22-36)41(52-40)33-48-29-34-17-7-2-8-18-34/h2-26,28,40-41,43-45H,27,29-33H2,1H3/b39-28+/t40-,41-,43-,44-,45-/m1/s1
InChI key: BTRWALCBUHZZRI-UIHOYFFISA-N
SMILES: COC(=O)/C=C(\C[C@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1)/c1ccccc1
Systematic name  (3):
  • (E)-3-フェニル-4-(2-O,3-O,4-O,6-O-テトラベンジル-α-D-マンノピラノシル)-2-ブテン酸メチル
  • メチル (2E)-3-フェニル-4-[(2R,3R,4R,5R,6R)-3,4,5-トリス(ベンジルオキシ)-6-[(ベンジルオキシ)メチル]オキサン-2-イル]ブタ-2-エノアート
  • methyl (2E)-3-phenyl-4-[(2R,3R,4R,5R,6R)-3,4,5-tris(benzyloxy)-6-[(benzyloxy)methyl]oxan-2-yl]but-2-enoate
Other name (1):
  • (E)-3-Phenyl-4-(2-O,3-O,4-O,6-O-tetrabenzyl-α-D-mannopyranosyl)-2-butenoic acid methyl ester
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