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Chemical structure of Zerumbone

GC40902

Zerumbone

Also known as (2Z,6Z,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one

Zerumbone is a natural monocyclic sesquiterpene first isolated from rhizomes of the wild ginger Z

ChemicalCAS471-05-6MW218.3FormulaC15H22O
CAS number
471-05-6
Molecular weight
218.3
Formula
C15H22O
Solubility
DMSO ： ≥ 125 mg/mL (572·53 mM)
InChIKey
GIHNTRQPEMKFKO-RTTFEGKLSA-N
Catalogue number
GC40902
Brand
GLPBIO
Computed properties PubChem CID 5372142 · XLogP 3.9 · TPSA 17.1 Ų · H-bond donors 0
XLogP
3.9
TPSA
17.1 Ų
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
16

SMILES C/C/1=C/CC(/C=C/C(=O)/C(=C\CC1)/C)(C)C

Computed descriptors from PubChem (CID 5372142), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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