In-Silico Structure database (LMISSD)
| |
LM ID | LMGL030496RW |
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Common Name | TG(P-18:1(9Z)/12:0/15:0) |
Systematic Name | 1-(1Z,9Z-octadecadienyl)-2-dodecanoyl-3-pentadecanoyl-sn-glycerol |
Synonyms | TG(P-45:1); TG(P-18:1_12:0_15:0) |
Exact Mass | |
Formula | C48H90O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | WNDCWAYXXJQVSD-ZWANMEHYSA-N |
InChI | InChI=1S/C48H90O5/c1-4-7-10-13-16-19-21-23-24-25-26-28-31-34-37-40-43-51-44-46(5 3-48(50)42-39-36-33-29-18-15-12-9-6-3)45-52-47(49)41-38-35-32-30-27-22-20-17-14- 11-8-5-2/h23-24,40,43,46H,4-22,25-39,41-42,44-45H2,1-3H3/b24-23-,43-40-/t46-/m1/ s1 |
SMILES | C(OC(=O)CCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |