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Chemical structure of Epimedoside A

GC38536

Epimedoside A

Also known as 5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one

Epimedoside A is a flavonoid isolated from the roots of Epimedium wushanense

ChemicalCAS39012-04-9MW662.64FormulaC32H38O15
CAS number
39012-04-9
Molecular weight
662.64
Formula
C32H38O15
Solubility
Methanol ： 6·25 mg/mL (9·43 mM; Need ultrasonic)
InChIKey
OGYXOOJUJQIDOX-FVCAYHPDSA-N
Catalogue number
GC38536
Brand
GLPBIO
Computed properties PubChem CID 5317093 · XLogP 1.3 · TPSA 245 Ų · H-bond donors 9
XLogP
1.3
TPSA
245 Ų
H-bond donors
9
H-bond acceptors
15
Rotatable bonds
8
Heavy atoms
47

SMILES C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=C(C2=O)C(=CC(=C3CC=C(C)C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)C5=CC=C(C=C5)O)O)O)O

Computed descriptors from PubChem (CID 5317093), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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