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Chemical structure of Ayanin

GC60063

Ayanin

Also known as 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxychromen-4-one

Ayanin is a bioflavonoid isolated from Croton schiedeanus Schlecht

ChemicalCAS572-32-7MW344.32FormulaC18H16O7
CAS number
572-32-7
Molecular weight
344.32
Formula
C18H16O7
Solubility
DMSO ： 250 mg/mL (726·07 mM; Need ultrasonic)
InChIKey
KPCRYSMUMBNTCK-UHFFFAOYSA-N
Catalogue number
GC60063
Brand
GLPBIO
Computed properties PubChem CID 5280682 · XLogP 3.1 · TPSA 94.5 Ų · H-bond donors 2
XLogP
3.1
TPSA
94.5 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
25

SMILES COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC)O

Computed descriptors from PubChem (CID 5280682), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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