In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049ABC |
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Common Name | TG(P-14:0/10:0/20:1(13E)) |
Systematic Name | 2-decanoyl-3-(13E-eicosenoyl)-sn-glycerol |
Synonyms | TG(P-44:1); TG(P-14:0_10:0_20:1) |
Exact Mass | |
Formula | C47H88O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | CRJMHLZDQYOJOT-HXKLIBAFSA-N |
InChI | InChI=1S/C47H88O5/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-29-32-34-37-40-46(48)5 1-44-45(52-47(49)41-38-35-31-15-12-9-6-3)43-50-42-39-36-33-30-28-21-19-17-14-11- 8-5-2/h18,20,39,42,45H,4-17,19,21-38,40-41,43-44H2,1-3H3/b20-18+,42-39-/t45-/m1/ s1 |
SMILES | C(OC(=O)CCCCCCCCCCC/C=C/CCCCCC)[C@]([H])(OC(CCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |