Chem
J-GLOBAL ID：200907042304746623   Nikkaji number：J1.414.248G

Hymenoside F

ヒメノシドF
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： C35H38O15
Molecular formula furigana： C35-H38-O15
Molecular weight： 698.674
InChI： InChI=1S/C35H38O15/c1-19(10-11-36)17-47-35-34(50-31(44)16-22-5-9-25(39)27(41)13-22)33(49-30(43)14-20-2-6-23(37)7-3-20)32(45)28(48-35)18-46-29(42)15-21-4-8-24(38)26(40)12-21/h2-10,12-13,28,32-41,45H,11,14-18H2,1H3/b19-10+/t28-,32-,33+,34-,35-/m1/s1
InChI key： VGBNAETXVFOJBG-CHJQGXMMSA-N
SMILES： C/C(=C\CO)/CO[C@@H]1O[C@H](COC(=O)Cc2ccc(O)c(O)c2)[C@@H](O)[C@H](OC(=O)Cc2ccc(O)cc2)[C@H]1OC(=O)Cc1ccc(O)c(O)c1
Systematic name  (3)：
  • 1-O-[(E)-2-メチル-4-ヒドロキシ-2-ブテニル]-β-D-グルコピラノース2,6-ビス(3,4-ジヒドロキシフェニルアセタート)3-(4-ヒドロキシフェニルアセタート)
  • [(2R,3R,4S,5R,6R)-5-{[2-(3,4-ジヒドロキシフェニル)アセチル]オキシ}-3-ヒドロキシ-6-{[(2E)-4-ヒドロキシ-2-メチルブタ-2-エン-1-イル]オキシ}-4-{[2-(4-ヒドロキシフェニル)アセチル]オキシ}オキサン-2-イル]メチル 2-(3,4-ジヒドロキシフェニル)アセタート
  • [(2R,3R,4S,5R,6R)-5-{[2-(3,4-dihydroxyphenyl)acetyl]oxy}-3-hydroxy-6-{[(2E)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-4-{[2-(4-hydroxyphenyl)acetyl]oxy}oxan-2-yl]methyl 2-(3,4-dihydroxyphenyl)acetate
Other name (3)：
  • 1-O-[(E)-2-Methyl-4-hydroxy-2-butenyl]-β-D-glucopyranose 2,6-bis(3,4-dihydroxyphenylacetate)3-(4-hydroxyphenylacetate)
  • ヒメノシドF
  • Hymenoside F
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