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Chemical structure of Erysubin B

GC76352

Erysubin B

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

Erysubin B is a prenylated isoflavonoid, which can be isolated from the whole plant (roots and aerial parts) of Erinacea anthyllis

ChemicalCAS221150-19-2MW352.34FormulaC20H16O6
CAS number
221150-19-2
Molecular weight
352.34
Formula
C20H16O6
InChIKey
OVLQTBOVUNAVGU-UHFFFAOYSA-N
Catalogue number
GC76352
Brand
GLPBIO
Computed properties PubChem CID 10760434 · XLogP 2.9 · TPSA 96.2 Ų · H-bond donors 3
XLogP
2.9
TPSA
96.2 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
26

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

Computed descriptors from PubChem (CID 10760434), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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