Chem
J-GLOBAL ID：200907062674760448   Nikkaji number：J1.911.044C

1-O,2-O,4-O-Tribenzyl-3-O-(methoxymethyl)-5-[(13C)methylene]-5-deoxy-D-arabinitol

1-O,2-O,4-O-トリベンジル-3-O-(メトキシメチル)-5-[(13C)メチレン]-5-デオキシ-D-アラビニトール
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： C28[13C]H34O5
Molecular formula furigana： C29-H34-O5
Molecular weight： 463.578
InChI： InChI=1S/C29H34O5/c1-3-27(32-20-25-15-9-5-10-16-25)29(34-23-30-2)28(33-21-26-17-11-6-12-18-26)22-31-19-24-13-7-4-8-14-24/h3-18,27-29H,1,19-23H2,2H3/t27-,28-,29-/m1/s1/i1+1
InChI key： JSEXRBQSIYSJAL-GACVUOJMSA-N
SMILES： COCO[C@@H]([C@@H](COCc1ccccc1)OCc1ccccc1)[C@H](OCc1ccccc1)C=[13CH2]
Systematic name  (3)：
  • 1-O,2-O,4-O-トリベンジル-3-O-(メトキシメチル)-5-[(13C)メチレン]-5-デオキシ-D-アラビニトール
  • ({[(2R,3R,4R)-2,4-ビス(ベンジルオキシ)-3-(メトキシメトキシ)(6-13C)ヘキサ-5-エン-1-イル]オキシ}メチル)ベンゼン
  • ({[(2R,3R,4R)-2,4-bis(benzyloxy)-3-(methoxymethoxy)(6-13C)hex-5-en-1-yl]oxy}methyl)benzene
Other name (1)：
  • 1-O,2-O,4-O-Tribenzyl-3-O-(methoxymethyl)-5-[(13C)methylene]-5-deoxy-D-arabinitol
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