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Chemical structure of Alpinumisoflavone

GC68644

Alpinumisoflavone

Also known as 5-hydroxy-7-(4-hydroxyphenyl)-2,2-dimethylpyrano[3,2-g]chromen-6-one

Alpinumisoflavone (compound 2) is a flavonoid compound isolated from the stem bark of prickly ash

ChemicalCAS34086-50-5MW336.34FormulaC20H16O5
CAS number
34086-50-5
Molecular weight
336.34
Formula
C20H16O5
Solubility
DMSO ： 100 mg/mL (297·32 mM; Need ultrasonic)
InChIKey
RQAMSFTXEFSBPK-UHFFFAOYSA-N
Catalogue number
GC68644
Brand
GLPBIO
Computed properties PubChem CID 5490139 · XLogP 3.9 · TPSA 76 Ų · H-bond donors 2
XLogP
3.9
TPSA
76 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
25

SMILES CC1(C=CC2=C(O1)C=C3C(=C2O)C(=O)C(=CO3)C4=CC=C(C=C4)O)C

Computed descriptors from PubChem (CID 5490139), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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