Chem
J-GLOBAL ID:201207097437647177
Nikkaji number:J3.014.127J
Methyl 2-O-[2-O-benzyl-3-O,4-O-dibenzoyl-α-L-fucopyranosyl]-3-O-benzyl-4-O,6-O-benzylidene-α-D-galactopyranoside
メチル2-O-[2-O-ベンジル-3-O,4-O-ジベンゾイル-α-L-フコピラノシル]-3-O-ベンジル-4-O,6-O-ベンジリデン-α-D-ガラクトピラノシド
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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:
C48 H48 O12
Molecular formula furigana:
C48-H48-O12
Molecular weight:
816.900
InChI:
InChI=1S/C48H48O12/c1-31-38(57-44(49)34-22-12-5-13-23-34)41(58-45(50)35-24-14-6-15-25-35)42(53-29-33-20-10-4-11-21-33)48(55-31)60-43-40(52-28-32-18-8-3-9-19-32)39-37(56-47(43)51-2)30-54-46(59-39)36-26-16-7-17-27-36/h3-27,31,37-43,46-48H,28-30H2,1-2H3/t31-,37+,38+,39-,40-,41+,42-,43+,46?,47-,48-/m0/s1
InChI key:
NQMVXMLGGIEYCC-MYCMMKECSA-N
SMILES:
CO[C@H]1O[C@@H]2COC(O[C@@H]2[C@H](OCc2ccccc2)[C@H]1O[C@@H]1O[C@@H](C)[C@@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OCc1ccccc1)c1ccccc1
Systematic name (3):
メチル2-O-[2-O-ベンジル-3-O,4-O-ジベンゾイル-α-L-フコピラノシル]-3-O-ベンジル-4-O,6-O-ベンジリデン-α-D-ガラクトピラノシド
(2S,3R,4R,5S,6S)-6-{[(4aR,6S,7R,8S,8aS)-8-(ベンジルオキシ)-6-メトキシ-2-フェニル-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-7-イル]オキシ}-4-(ベンゾイルオキシ)-5-(ベンジルオキシ)-2-メチルオキサン-3-イル ベンゾアート
(2S,3R,4R,5S,6S)-6-{[(4aR,6S,7R,8S,8aS)-8-(benzyloxy)-6-methoxy-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl]oxy}-4-(benzoyloxy)-5-(benzyloxy)-2-methyloxan-3-yl benzoate
Other name (1):
Methyl 2-O-[2-O-benzyl-3-O,4-O-dibenzoyl-α-L-fucopyranosyl]-3-O-benzyl-4-O,6-O-benzylidene-α-D-galactopyranoside
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