In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049BBB |
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Common Name | TG(P-14:0/18:1(11Z)/14:1(9Z)) |
Systematic Name | 2-(11Z-octadecenoyl)-3-(9Z-tetradecenoyl)-sn-glycerol |
Synonyms | TG(P-46:2); TG(P-14:0_14:1_18:1) |
Exact Mass | |
Formula | C49H90O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | PARRKOZZKHPYCU-MTGQJAPBSA-N |
InChI | InChI=1S/C49H90O5/c1-4-7-10-13-16-19-22-24-25-26-28-31-34-37-40-43-49(51)54-47(4 5-52-44-41-38-35-32-29-23-20-17-14-11-8-5-2)46-53-48(50)42-39-36-33-30-27-21-18- 15-12-9-6-3/h15,18-19,22,41,44,47H,4-14,16-17,20-21,23-40,42-43,45-46H2,1-3H3/b1 8-15-,22-19-,44-41-/t47-/m1/s1 |
SMILES | C(OC(=O)CCCCCCC/C=C\CCCC)[C@]([H])(OC(CCCCCCCCC/C=C\CCCCCC)=O)CO/C=C\CCCCCCCCCCC C |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |