In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03019KZD |
---|---|
Common Name | TG(12:0/11:0/12:0) |
Systematic Name | 1,3-di-dodecanoyl-2-undecanoyl-sn-glycerol |
Synonyms | TG(35:0); TG(11:0_12:0_12:0) |
Exact Mass | |
Formula | C38H72O6 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Triacylglycerols [GL0301] |
PubChem Compound ID (CID) | - |
InChIKey | NWPQELMCPHEIOL-UHFFFAOYSA-N |
InChI | InChI=1S/C38H72O6/c1-4-7-10-13-16-19-22-24-27-30-36(39)42-33-35(44-38(41)32-29-2 6-21-18-15-12-9-6-3)34-43-37(40)31-28-25-23-20-17-14-11-8-5-2/h35H,4-34H2,1-3H3 |
SMILES | C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)COC(CCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |