In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049AE1 |
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Common Name | TG(P-14:0/12:0/14:1(9Z)) |
Systematic Name | 2-dodecanoyl-3-(9Z-tetradecenoyl)-sn-glycerol |
Synonyms | TG(P-40:1); TG(P-14:0_12:0_14:1) |
Exact Mass | |
Formula | C43H80O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | VJJQUMNXTZRQRU-UCUBVMEGSA-N |
InChI | InChI=1S/C43H80O5/c1-4-7-10-13-16-19-21-23-26-29-32-35-38-46-39-41(48-43(45)37-3 4-31-28-24-18-15-12-9-6-3)40-47-42(44)36-33-30-27-25-22-20-17-14-11-8-5-2/h14,17 ,35,38,41H,4-13,15-16,18-34,36-37,39-40H2,1-3H3/b17-14-,38-35-/t41-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\CCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |