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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: 25.496
- ECL on Wax: 23.812
- ECL on DB225: 22.946
- ECL on 5% phenyl: 19.617
- ECL on Rxi-1: 19.436
- KI on DB225: 2907
- KI on 5% phenyl: 2290
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
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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. |