In-Silico Structure database (LMISSD)
| |
LM ID | LMGL030496RS |
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Common Name | TG(P-18:1(9Z)/12:0/12:0) |
Systematic Name | 1-(1Z,9Z-octadecadienyl)-2-dodecanoyl-3-dodecanoyl-sn-glycerol |
Synonyms | TG(P-42:1); TG(P-18:1_12:0_12:0) |
Exact Mass | |
Formula | C45H84O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | PCGUDHCKYYSCAL-VKRONGSLSA-N |
InChI | InChI=1S/C45H84O5/c1-4-7-10-13-16-19-20-21-22-23-24-25-28-31-34-37-40-48-41-43(5 0-45(47)39-36-33-30-27-18-15-12-9-6-3)42-49-44(46)38-35-32-29-26-17-14-11-8-5-2/ h21-22,37,40,43H,4-20,23-36,38-39,41-42H2,1-3H3/b22-21-,40-37-/t43-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCC)[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) |