Basic information
- CAS
94300-40-0- Standard SMILES
O=C(O)CCCCCCCCCCC1C=CCC1- InChIKey
SRELFLQJDOTNLJ-UHFFFAOYSA-N- Molecular formula
- C16H28O2
- Average molar mass
- 252.39 g/mol
- Monoisotopic mass
- 252.20893013
Overview
Hydnocarpic acid is a cyclopentenyl fatty acid consisting of undecanoic acid having a cyclopent-2-enyl group at the 11-position. It is a long-chain fatty acid, a cyclopentenyl fatty acid and a monounsaturated fatty acid.
Names & identifiers
- Preferred name
- 2-Cyclopentene-1-undecanoic acid
- IUPAC
- 11-cyclopent-2-en-1-ylundecanoic acid
Names & synonyms
2-Cyclopentene-1-undecanoic acidDL-Hydnocarpic acid94300-40-0NSC-31395011-cyclopent-2-en-1-ylundecanoic acidU88T2W388KHydnocarpic acid DL-RefChem:1062946HYDNOCARPIC ACID, (A+-)-Hydnocarpic acid, (+/-)-Hydnocarpic acid DL-form [MI]d-Hydnocarpic acid
Show more names
UNII-U88T2W388KNSC313950NSC51168Hydnocarpsaeure(+/-)-hydnocarpic acidHYDNOCARPIC ACID,(D)SCHEMBL580439SRELFLQJDOTNLJ-UHFFFAOYSA-N
Database identifiers
- CAS
94300-40-0- PubChem CID
- 110680
- DTXSID
DTXSID901377178- ChEBI
CHEBI:61671- UNII
- U88T2W388K
- Nikkaji
- J5.764I
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 245
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Carbocyclic fatty acids [FA0114]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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