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Chemical structure of Valerenolic acid

GC39712

Valerenolic acid

Also listed as Hydroxyvalerenic acid

Hydroxyvalerenic acid is isolated from Verbena officinalis, has a low toxicity with IC50 values of 123 and 165 μM against GLC4 and COLO 320 cells, respectively

ChemicalCAS1619-16-5MW250.33FormulaC15H22O3
CAS number
1619-16-5
Molecular weight
250.33
Formula
C15H22O3
Solubility
Soluble in DMSO
InChIKey
XJNQXTISSHEQKD-UXBLZVDNSA-N
Catalogue number
GC39712
Brand
GLPBIO
Computed properties PubChem CID 6439586 · XLogP 2.1 · TPSA 57.5 Ų · H-bond donors 2
XLogP
2.1
TPSA
57.5 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18

SMILES CC1CCC(C2=C(CC(C12)O)C)/C=C(\C)/C(=O)O

Computed descriptors from PubChem (CID 6439586), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
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