In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049AQS |
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Common Name | TG(P-14:0/15:1(9Z)/17:2(9Z,12Z)) |
Systematic Name | 2-(9Z-pentadecenoyl)-3-(9Z,12Z-heptadecadienoyl)-sn-glycerol |
Synonyms | TG(P-46:3); TG(P-14:0_15:1_17:2) |
Exact Mass | |
Formula | C49H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | AWUKGFVKPCWOSG-XKWORMOOSA-N |
InChI | InChI=1S/C49H88O5/c1-4-7-10-13-16-19-22-25-26-28-30-33-36-39-42-48(50)53-46-47(4 5-52-44-41-38-35-32-29-24-21-18-15-12-9-6-3)54-49(51)43-40-37-34-31-27-23-20-17- 14-11-8-5-2/h13,16-17,20,22,25,41,44,47H,4-12,14-15,18-19,21,23-24,26-40,42-43,4 5-46H2,1-3H3/b16-13-,20-17-,25-22-,44-41-/t47-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\C/C=C\CCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCC)=O)CO/C=C\CCCCCCCC CCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |