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MOH-709 / Ricinoleic acid ME / 12-hydroxy-cis-9-octadecenoic acid ME

Names: Methyl (9Z,12R)-12-Hydroxy-9-octadecenoate;  (9Z,12R)-12-Hydroxy-9-octadecenoic acid methyl ester;  12R-Hydroxy-9Z-octadecenoic acid methyl ester;  Methyl ricinoleate;  Ricinoleic acid methyl ester

Formula: C19H36O3

Molar mass: 312.492 Da

Monoisotopic mass: 312.266 Da

SMILES: CCCCCC[C@@H](O)C/C=C\CCCCCCCC(OC)=O

InChI Key: XKGDWZQXVZSXAO-ADYSOMBNSA-N

InChI: 1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10-/t18-/m1/s1

Typical retention indexes:
- ECL on BPX70: 25.522
- ECL on BP20: 23.829
- ECL on DB225: 22.946

Non-derivatized:

Names: (Z,12R)-12-hydroxyoctadec-9-enoic acid;  12R-Hydroxy-9Z-octadecenoic acid;  Ricinoleic acid

Formula: C18H34O3

Molar mass: 298.465 Da

SMILES: CCCCCC[C@@H](O)C\C=C/CCCCCCCC(O)=O

InChI Key: WBHHMMIMDMUBKC-QJWNTBNXSA-N

InChI: 1S/C18H34O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12,17,19H,2-8,10-11,13-16H2,1H3,(H,20,21)/b12-9-/t17-/m1/s1

ChEBI code: CHEBI:28592

Lipid Maps code: LMFA02000184



Data are acquired on Agilent 5972, 5973 and 5975 instruments at Nofima, Institute of Marine Research and University of Bergen.
Molecular structures are created in Open Babel.