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Chemical structure of (-)-Guaiol

GC41344

(-)-Guaiol

Also known as 2-[(3R,5S,8R)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol

(-)-Guaiol is a sesquiterpene alcohol that has been found in several traditional Chinese medicinal plants and has antiproliferative, pro-autophagic, insect repellent, and insecticidal biological activities

ChemicalCAS489-86-1MW222.4FormulaC15H26O
CAS number
489-86-1
Molecular weight
222.4
Formula
C15H26O
Solubility
DMF: 30 mg/ml,DMSO: 30 mg/ml,Ethanol: 30 mg/ml,Ethanol:PBS(pH 7·2) (1:1): 0·5 mg/ml
InChIKey
TWVJWDMOZJXUID-UTUOFQBUSA-N
Catalogue number
GC41344
Brand
GLPBIO
Computed properties PubChem CID 72607 · XLogP 3.1 · TPSA 20.2 Ų · H-bond donors 1
XLogP
3.1
TPSA
20.2 Ų
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
16

SMILES C[C@@H]1CC[C@@H](CC2=C1CC[C@H]2C)C(C)(C)O

Computed descriptors from PubChem (CID 72607), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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