Chem
J-GLOBAL ID：200907050412998720   Nikkaji number：J1.893.038B

1-O-(4-Methoxyphenyl)-4-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-β-D-glucopyranose 2,3,6-tribenzoate

1-O-(4-メトキシフェニル)-4-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-β-D-グルコピラノース2,3,6-トリベンゾアート
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： C48H48O19
Molecular formula furigana： C48-H48-O19
Molecular weight： 928.893
InChI： InChI=1S/C48H48O19/c1-27(49)57-25-36-38(59-28(2)50)40(60-29(3)51)42(61-30(4)52)48(64-36)67-39-37(26-58-44(53)31-15-9-6-10-16-31)63-47(62-35-23-21-34(56-5)22-24-35)43(66-46(55)33-19-13-8-14-20-33)41(39)65-45(54)32-17-11-7-12-18-32/h6-24,36-43,47-48H,25-26H2,1-5H3/t36-,37-,38+,39-,40+,41+,42-,43-,47-,48+/m1/s1
InChI key： NLVGCNAUYVIIPN-HGSUOHGTSA-N
SMILES： COc1ccc(O[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](O[C@@H]3O[C@H](COC(=O)C)[C@H](OC(=O)C)[C@H](OC(=O)C)[C@H]3OC(=O)C)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1
Systematic name  (3)：
  • 1-O-(4-メトキシフェニル)-4-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-β-D-グルコピラノース2,3,6-トリベンゾアート
  • [(2R,3R,4S,5R,6S)-4,5-ビス(ベンゾイルオキシ)-6-(4-メトキシフェノキシ)-3-{[(2S,3R,4S,5S,6R)-3,4,5-トリス(アセチルオキシ)-6-[(アセチルオキシ)メチル]オキサン-2-イル]オキシ}オキサン-2-イル]メチル ベンゾアート
  • [(2R,3R,4S,5R,6S)-4,5-bis(benzoyloxy)-6-(4-methoxyphenoxy)-3-{[(2S,3R,4S,5S,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]methyl benzoate
Other name (1)：
  • 1-O-(4-Methoxyphenyl)-4-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-β-D-glucopyranose 2,3,6-tribenzoate
Thsaurus map：
Thesaurus Map

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