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Chemical structure of β-Amyrenonol

GC61997

β-Amyrenonol

Also known as (4aR,6aR,6aS,6bR,8aR,10S,12aS,14bR)-10-hydroxy-2,2,4a,6a,6b,9,9,12a-octamethyl-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picen-13-one

β-Amyrenonol (11-Oxo-β-amyrin), an oleanolic-type triterpenoid in licorice roots, is a precursor of Glycyrrhetinic acid

ChemicalCAS38242-02-3MW440.7FormulaC30H48O2
CAS number
38242-02-3
Molecular weight
440.7
Formula
C30H48O2
InChIKey
UKAIYBGRLWQHDQ-KWRVYEIKSA-N
Catalogue number
GC61997
Brand
GLPBIO
Computed properties PubChem CID 20055661 · XLogP 8.1 · TPSA 37.3 Ų · H-bond donors 1
XLogP
8.1
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
32

SMILES C[C@@]12CC[C@@]3(C(=CC(=O)[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]1CC(CC2)(C)C)C

Computed descriptors from PubChem (CID 20055661), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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