In-Silico Structure database (LMISSD)
| |
LM ID | LMGL03049B9R |
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Common Name | TG(P-14:0/18:3(9Z,12Z,15Z)/10:0) |
Systematic Name | 2-(9Z,12Z,15Z-octadecatrienoyl)-3-decanoyl-sn-glycerol |
Synonyms | TG(P-42:3); TG(P-14:0_10:0_18:3) |
Exact Mass | |
Formula | C45H80O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | SGEZBXRZVXQBHD-AYKBARMQSA-N |
InChI | InChI=1S/C45H80O5/c1-4-7-10-13-16-18-20-22-23-24-25-27-30-33-36-39-45(47)50-43(4 2-49-44(46)38-35-32-29-15-12-9-6-3)41-48-40-37-34-31-28-26-21-19-17-14-11-8-5-2/ h7,10,16,18,22-23,37,40,43H,4-6,8-9,11-15,17,19-21,24-36,38-39,41-42H2,1-3H3/b10 -7-,18-16-,23-22-,40-37-/t43-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)CO/C=C\CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |