Showing Metabocard for 10,13-dihydroxyoctadecanoate (BASm0012591)
Common Name | 10,13-dihydroxyoctadecanoate |
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Description | A hydroxy fatty acid anion that is the conjugate base of 10,13-dihydroxyoctadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. |
Structure | |
Molecular Formula | C18H35O4 |
Average Mass | 315.47500 |
Monoisotopic Mass | Not Available |
IUPAC Name | Not Available |
Traditional Name | Not Available |
CAS Registry Number | Not Available |
SMILES | CCCCCC(O)CCC(O)CCCCCCCCC(=O)[O-] |
InChI Identifier | InChI=1S/C18H36O4/c1-2-3-8-11-16(19)14-15-17(20)12-9-6-4-5-7-10-13-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)/p-1 |
InChI Key | NMQSHRONGDFSQZ-UHFFFAOYSA-M |
CHEBI ID | CHEBI:195301 |
State | Not Available |
Water Solubility | Not Available |
logS | Not Available |
pKa (Strongest Acidic) | Not Available |
pKa (Strongest Basic) | Not Available |
Hydrogen Acceptor Count | Not Available |
Hydrogen Donor Count | Not Available |
Rotatable Bond Count | Not Available |
Physiological Charge | Not Available |
Formal Charge | -1 |
Polarizability | Not Available |