In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049BO7 |
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Common Name | TG(P-14:0/18:1(9E)/15:1(9Z)) |
Systematic Name | 2-(9E-octadecenoyl)-3-(9Z-pentadecenoyl)-sn-glycerol |
Synonyms | TG(P-47:2); TG(P-14:0_15:1_18:1) |
Exact Mass | |
Formula | C50H92O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | HAJWQBVWOKLTDS-YDGAHSCGSA-N |
InChI | InChI=1S/C50H92O5/c1-4-7-10-13-16-19-22-25-26-27-29-32-35-38-41-44-50(52)55-48(4 6-53-45-42-39-36-33-30-24-21-18-15-12-9-6-3)47-54-49(51)43-40-37-34-31-28-23-20- 17-14-11-8-5-2/h17,20,25-26,42,45,48H,4-16,18-19,21-24,27-41,43-44,46-47H2,1-3H3 /b20-17-,26-25+,45-42-/t48-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\CCCCC)[C@]([H])(OC(CCCCCCC/C=C/CCCCCCCC)=O)CO/C=C\CCCCCCCCCC CC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |