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Chemical structure of Kadsurenin B

GC71939

Kadsurenin B

Also known as (1S,5R,6R,7R)-7-(1,3-benzodioxol-5-yl)-8-hydroxy-5-methoxy-6-methyl-3-prop-2-enylbicyclo[3.2.1]oct-3-en-2-one

Kadsurenin B is a PAF (platelet-activating factor) antagonist with neuroprotective activity

ChemicalCAS145701-13-9MW342.39FormulaC20H22O5
CAS number
145701-13-9
Molecular weight
342.39
Formula
C20H22O5
InChIKey
ARFBOYDNJXQGTO-ARQBSGROSA-N
Catalogue number
GC71939
Brand
GLPBIO
Computed properties PubChem CID 102481771 · XLogP 2.4 · TPSA 65 Ų · H-bond donors 1
XLogP
2.4
TPSA
65 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
25

SMILES C[C@@H]1[C@H]([C@H]2C([C@@]1(C=C(C2=O)CC=C)OC)O)C3=CC4=C(C=C3)OCO4

Computed descriptors from PubChem (CID 102481771), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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