Chem
J-GLOBAL ID:200907018365973799   Nikkaji number:J1.651.486A

Allyl 2-O,3-O-dibenzyl-4-O-(2-O,3-O-dibenzyl-4-O-methyl-6-oxo-6-O-methyl-β-D-galactopyranosyl)-α-D-galactopyranosiduronic acid methyl ester

アリル2-O,3-O-ジベンジル-4-O-(2-O,3-O-ジベンジル-4-O-メチル-6-オキソ-6-O-メチル-β-D-ガラクトピラノシル)-α-D-ガラクトピラノシドウロン酸メチル
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: C46H52O13
Molecular formula furigana: C46-H52-O13
Molecular weight: 812.909
InChI: InChI=1S/C46H52O13/c1-5-26-52-45-41(55-29-33-22-14-8-15-23-33)37(54-28-32-20-12-7-13-21-32)38(40(58-45)44(48)51-4)57-46-42(56-30-34-24-16-9-17-25-34)36(53-27-31-18-10-6-11-19-31)35(49-2)39(59-46)43(47)50-3/h5-25,35-42,45-46H,1,26-30H2,2-4H3/t35-,36+,37+,38-,39+,40+,41-,42-,45+,46-/m1/s1
InChI key: RRDVYPZBQZTNQF-MNKUFPRSSA-N
SMILES: CO[C@@H]1[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](O[C@@H]2[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H](OCC=C)O[C@@H]2C(=O)OC)O[C@@H]1C(=O)OC
Systematic name  (3):
  • アリル2-O,3-O-ジベンジル-4-O-(2-O,3-O-ジベンジル-4-O-メチル-6-オキソ-6-O-メチル-β-D-ガラクトピラノシル)-α-D-ガラクトピラノシドウロン酸メチル
  • メチル (2S,3R,4S,5R,6R)-4,5-ビス(ベンジルオキシ)-6-{[(2S,3R,4S,5R,6S)-4,5-ビス(ベンジルオキシ)-2-(メトキシカルボニル)-6-(プロパ-2-エン-1-イルオキシ)オキサン-3-イル]オキシ}-3-メトキシオキサン-2-カルボキシラート
  • methyl (2S,3R,4S,5R,6R)-4,5-bis(benzyloxy)-6-{[(2S,3R,4S,5R,6S)-4,5-bis(benzyloxy)-2-(methoxycarbonyl)-6-(prop-2-en-1-yloxy)oxan-3-yl]oxy}-3-methoxyoxane-2-carboxylate
Other name (1):
  • Allyl 2-O,3-O-dibenzyl-4-O-(2-O,3-O-dibenzyl-4-O-methyl-6-oxo-6-O-methyl-β-D-galactopyranosyl)-α-D-galactopyranosiduronic acid methyl ester
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