In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03029K33 |
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Common Name | TG(O-16:1(11Z)/13:0/15:0) |
Systematic Name | 1-(11Z-hexadecenyl)-2-tridecanoyl-3-pentadecanoyl-sn-glycerol |
Synonyms | TG(O-44:1); TG(O-16:1_13:0_15:0) |
Exact Mass | |
Formula | C47H90O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | DDPUDAHLRBTUEI-POADKRFTSA-N |
InChI | InChI=1S/C47H90O5/c1-4-7-10-13-16-19-22-24-25-27-30-33-36-39-42-50-43-45(52-47(4 9)41-38-35-32-28-21-18-15-12-9-6-3)44-51-46(48)40-37-34-31-29-26-23-20-17-14-11- 8-5-2/h13,16,45H,4-12,14-15,17-44H2,1-3H3/b16-13-/t45-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCC)=O)COCCCCCCCCCC/C=C\CCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |