In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0301CDWW |
---|---|
Common Name | TG(18:1(7Z)/10:0/11:0) |
Systematic Name | 1-(7Z-octadecenoyl)-2-decanoyl-3-undecanoyl-sn-glycerol |
Synonyms | TG(39:1); TG(10:0_11:0_18:1) |
Exact Mass | |
Formula | C42H78O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | HKXYZSZBKPTZMU-OBJSZRLOSA-N |
InChI | InChI=1S/C42H78O6/c1-4-7-10-13-16-18-19-20-21-22-23-24-27-29-32-35-41(44)47-38-3 9(48-42(45)36-33-30-25-15-12-9-6-3)37-46-40(43)34-31-28-26-17-14-11-8-5-2/h22-23 ,39H,4-21,24-38H2,1-3H3/b23-22-/t39-/m0/s1 |
SMILES | C(OC(=O)CCCCCCCCCC)[C@]([H])(OC(CCCCCCCCC)=O)COC(CCCCC/C=C\CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |