In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03029KYC |
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Common Name | TG(O-16:1(11Z)/10:0/20:4(6E,8Z,11Z,14Z)) |
Systematic Name | 1-(11Z-hexadecenyl)-2-decanoyl-3-(6E,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol |
Synonyms | TG(O-46:5); TG(O-16:1_10:0_20:4) |
Exact Mass | |
Formula | C49H86O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | Alkyldiacylglycerols [GL0302] |
PubChem Compound ID (CID) | - |
InChIKey | FAYUZOBRAIUWMD-HTLCWTLASA-N |
InChI | InChI=1S/C49H86O5/c1-4-7-10-13-16-18-20-22-24-25-26-27-29-31-34-36-39-42-48(50)5 3-46-47(54-49(51)43-40-37-33-15-12-9-6-3)45-52-44-41-38-35-32-30-28-23-21-19-17- 14-11-8-5-2/h14,16-18,22,24,26-27,29,31,47H,4-13,15,19-21,23,25,28,30,32-46H2,1- 3H3/b17-14-,18-16-,24-22-,27-26-,31-29+/t47-/m1/s1 |
SMILES | C(OC(=O)CCCC/C=C/C=C\C/C=C\C/C=C\CCCCC)[C@]([H])(OC(CCCCCCCCC)=O)COCCCCCCCCCC/C= C\CCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |