Molecular Identity
Cetoleic acid
(Z)-docos-11-enoic acid
PubChem CID: 5282771
Cetoleic acid is a docosenoic acid having a cis-double bond at position 11. It has a role as a Daphnia tenebrosa metabolite. It is a conjugate acid of a cetoleate.
2D Structure
Properties
C22H42O2
Molecular Formula
338.60
Molecular Weight
g/mol
338.3185
Exact Mass
Da
8.7
XLogP
Above Lipinski threshold
37.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
284
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Cetoleic acid(Z)-docos-11-enoic acid1002-96-6cis-11-docosenoic acid11Z-docosenoic acid(Z)-11-docosenoic acid11-Docosenoic acid, (Z)-62EZI2C5SEcis-docos-11-enoic acid22:1, n-11 cisJ12.483DCHEBI:3242822:1(N-11)11-docosaenoic acidRefChem:32120
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Cetoleic acid
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