In-Silico Structure database (LMISSD)
| |
LM ID | LMGL02019HEA |
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Common Name | DG(18:2(9Z,11Z)/0:0/13:0) |
Systematic Name | 1-(9Z,11Z-octadecadienoyl)-3-tridecanoyl-sn-glycerol |
Synonyms | DG(31:2); DG(13:0_18:2) |
Exact Mass | |
Formula | C34H62O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | HEYAQKNDLQLDBF-BRPVJPMYSA-N |
InChI | InChI=1S/C34H62O5/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-34(37)39-31-32( 35)30-38-33(36)28-26-24-22-20-14-12-10-8-6-4-2/h13,15-17,32,35H,3-12,14,18-31H2, 1-2H3/b15-13-,17-16-/t32-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCC)[C@]([H])(O)COC(CCCCCCC/C=C\C=C/CCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |