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Chemical structure of Kuwanon O

GC76272

Kuwanon O

Also known as (2S)-2-[3-[(1S,5R,6S)-6-[2,4-dihydroxy-3-(3-methylbut-2-enyl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-2,4-dihydroxyphenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

Kuwanon O is a flavonoid derivative with a fused dihydrochalcone partial moiety, that can be isolated from the root bark of Morus lhou (set

ChemicalCAS89200-01-1MW694.72FormulaC40H38O11
CAS number
89200-01-1
Molecular weight
694.72
Formula
C40H38O11
InChIKey
YIHMXHFAOIEYBW-BHNQILPDSA-N
Catalogue number
GC76272
Brand
GLPBIO
Computed properties PubChem CID 102075992 · XLogP 7 · TPSA 205 Ų · H-bond donors 8
XLogP
7
TPSA
205 Ų
H-bond donors
8
H-bond acceptors
11
Rotatable bonds
7
Heavy atoms
51

SMILES CC1=C[C@@H]([C@H]([C@@H](C1)C2=C(C=C(C=C2)O)O)C(=O)C3=C(C(=C(C=C3)O)CC=C(C)C)O)C4=C(C=CC(=C4O)[C@@H]5CC(=O)C6=C(C=C(C=C6O5)O)O)O

Computed descriptors from PubChem (CID 102075992), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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