Chem
J-GLOBAL ID：200907056472363692   Nikkaji number：J510.897G

Angustifolioside B

アングスチホリオシドB
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： C31H42O17
Molecular formula furigana： C31-H42-O17
Molecular weight： 686.660
InChI： InChI=1S/C31H42O17/c1-3-16-17(18(28(41)42-2)13-44-29(16)48-31-27(40)25(38)23(36)20(12-33)47-31)10-21(34)43-9-8-14-4-6-15(7-5-14)45-30-26(39)24(37)22(35)19(11-32)46-30/h3-7,13,17,19-20,22-27,29-33,35-40H,8-12H2,1-2H3/b16-3+/t17-,19+,20+,22+,23+,24-,25-,26+,27+,29-,30+,31-/m0/s1
InChI key： AZIMXRPUOIPIKL-DTYPFZMBSA-N
SMILES： COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C)/[C@@H]1CC(=O)OCCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Systematic name  (3)：
  • (5E)-6α-(β-D-グルコピラノシルオキシ)-5-エチリデン-4β-[[2-[4-(β-D-グルコピラノシルオキシ)フェニル]エトキシ]カルボニルメチル]-5,6-ジヒドロ-4H-ピラン-3-カルボン酸メチル
  • メチル (2S,3E,4S)-3-エチリデン-4-{2-オキソ-2-[2-(4-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}フェニル)エトキシ]エチル}-2-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-3,4-ジヒドロ-2H-ピラン-5-カルボキシラート
  • methyl (2S,3E,4S)-3-ethylidene-4-{2-oxo-2-[2-(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethoxy]ethyl}-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate
Other name (3)：
  • アングスチホリオシドB
  • Angustifolioside B
  • (5E)-6α-(β-D-Glucopyranosyloxy)-5-ethylidene-4β-[[2-[4-(β-D-glucopyranosyloxy)phenyl]ethoxy]carbonylmethyl]-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM