In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049B7H |
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Common Name | TG(P-14:0/18:3(6Z,9Z,12Z)/11:0) |
Systematic Name | 2-(6Z,9Z,12Z-octadecatrienoyl)-3-undecanoyl-sn-glycerol |
Synonyms | TG(P-43:3); TG(P-14:0_11:0_18:3) |
Exact Mass | |
Formula | C46H82O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | HBRCHWRCWGAPOM-ZXUQUUGKSA-N |
InChI | InChI=1S/C46H82O5/c1-4-7-10-13-16-19-21-23-24-25-26-28-31-34-37-40-46(48)51-44(4 3-50-45(47)39-36-33-30-18-15-12-9-6-3)42-49-41-38-35-32-29-27-22-20-17-14-11-8-5 -2/h16,19,23-24,26,28,38,41,44H,4-15,17-18,20-22,25,27,29-37,39-40,42-43H2,1-3H3 /b19-16-,24-23-,28-26-,41-38-/t44-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\CCCCC)=O)CO/C=C\CCCCCCCCCCC C |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |