In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049SUW |
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Common Name | TG(P-16:1(9Z)/20:2(5Z,8Z)/10:0) |
Systematic Name | 1-(1Z,9Z-hexadecadienyl)-2-(5Z,8Z-eicosadienoyl)-3-decanoyl-sn-glycerol |
Synonyms | TG(P-46:3); TG(P-16:1_10:0_20:2) |
Exact Mass | |
Formula | C49H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | PLQLNSUUISRSNY-YPALIWEJSA-N |
InChI | InChI=1S/C49H88O5/c1-4-7-10-13-16-18-20-22-24-25-26-27-29-31-34-37-40-43-49(51)5 4-47(46-53-48(50)42-39-36-33-15-12-9-6-3)45-52-44-41-38-35-32-30-28-23-21-19-17- 14-11-8-5-2/h19,21,26-27,31,34,41,44,47H,4-18,20,22-25,28-30,32-33,35-40,42-43,4 5-46H2,1-3H3/b21-19-,27-26-,34-31-,44-41-/t47-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCC/C=C\C/C=C\CCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CC CCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |