In-Silico Structure database (LMISSD)
| |
LM ID | LMFA0709A013 |
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Common Name | FAHFA 18:3(6Z,9Z,12Z)/12O(FA 18:0) |
Systematic Name | 12-O-6Z,9Z,12Z-octadecatrienoyl-12-hydroxyoctadecanoic acid |
Synonyms | - |
Exact Mass | |
Formula | C36H64O4 |
Category | Fatty Acyls [FA] |
Main Class | Fatty esters [FA07] |
Sub Class | Fatty acid estolides [FA0709] |
PubChem Compound ID (CID) | - |
InChIKey | YVKZFEILPDFONI-NWFXIAEYSA-N |
InChI | InChI=1S/C36H64O4/c1-3-5-7-9-10-11-12-13-14-15-16-17-22-25-29-33-36(39)40-34(30- 26-8-6-4-2)31-27-23-20-18-19-21-24-28-32-35(37)38/h10-11,13-14,16-17,34H,3-9,12, 15,18-33H2,1-2H3,(H,37,38)/b11-10-,14-13-,17-16- |
SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC(CCCCCC)CCCCCCCCCCC(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |