Chem
J-GLOBAL ID:200907044872586420   Nikkaji number:J976.610C

Lyciumoside IV

リシュウモシドIV
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: C38H64O16
Molecular formula furigana: C38-H64-O16
Molecular weight: 776.914
InChI: InChI=1S/C38H64O16/c1-7-38(6,54-37-33(48)30(45)34(25(18-40)52-37)53-36-32(47)28(43)26(41)23(5)50-36)16-10-15-21(3)12-8-11-20(2)13-9-14-22(4)19-49-35-31(46)29(44)27(42)24(17-39)51-35/h7,11,14-15,23-37,39-48H,1,8-10,12-13,16-19H2,2-6H3/b20-11+,21-15+,22-14-/t23-,24+,25+,26-,27+,28+,29-,30+,31+,32+,33+,34+,35+,36-,37-,38+/m0/s1
InChI key: OEOWMDSFDQHCFJ-JUMADDCISA-N
SMILES: C[C@@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@](C)(CC/C=C(\C)/CC/C=C(\C)/CC/C=C(/C)\CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (3):
  • [(2Z,6E,10E,14S)-14-[[4-O-(6-デオキシ-α-L-マンノピラノシル)-β-D-グルコピラノシル]オキシ]-2,6,10,14-テトラメチル-2,6,10,15-ヘキサデカテトラエニル]β-D-グルコピラノシド
  • (2S,3R,4R,5R,6S)-2-{[(2R,3S,4R,5R,6S)-4,5-ジヒドロキシ-2-(ヒドロキシメチル)-6-{[(3S,6E,10E,14Z)-3,7,11,15-テトラメチル-16-{[(2R,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}ヘキサデカ-1,6,10,14-テトラエン-3-イル]オキシ}オキサン-3-イル]オキシ}-6-メチルオキサン-3,4,5-トリオール
  • (2S,3R,4R,5R,6S)-2-{[(2R,3S,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-{[(3S,6E,10E,14Z)-3,7,11,15-tetramethyl-16-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadeca-1,6,10,14-tetraen-3-yl]oxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
Other name (3):
  • [(2Z,6E,10E,14S)-14-[[4-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,6,10,14-tetramethyl-2,6,10,15-hexadecatetrenyl]β-D-glucopyranoside
  • リシュウモシドIV
  • Lyciumoside IV
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