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Chemical structure of 12-Methoxycarnosic Acid

GC64008

12-Methoxycarnosic Acid

Also listed as 12-O-Methylcarnosic acid

12-O-Methylcarnosic acid (12-Methoxycarnosic acid), a diterpene carnosic acid isolated from the acetone extract of Salvia microphylla, is an active constituent of 5α-reductase inhibition with an IC50 value of 61·7 μM

ChemicalCAS62201-71-2MW346.46FormulaC21H30O4
CAS number
62201-71-2
Molecular weight
346.46
Formula
C21H30O4
Solubility
DMSO : 50 mg/mL (144·32 mM; Need ultrasonic)
InChIKey
QQNSARJGBPMQDI-YCRPNKLZSA-N
Catalogue number
GC64008
Brand
GLPBIO
Computed properties PubChem CID 9974918 · XLogP 5.2 · TPSA 66.8 Ų · H-bond donors 2
XLogP
5.2
TPSA
66.8 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25

SMILES CC(C)C1=C(C(=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C(=O)O)O)OC

Computed descriptors from PubChem (CID 9974918), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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