In-Silico Structure database (LMISSD)
| |
LM ID | LMGL05019CB5 |
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Common Name | MGDG(18:4(6Z,9Z,12Z,15Z)/13:0) |
Systematic Name | 1-(6Z,9Z,12Z,15Z-octadecatetraenoyl),2-tridecanoyl-3-3-O-β-D-galactosyl-sn- glycerol |
Synonyms | MGDG(31:4); MGDG(13:0_18:4) |
Exact Mass | |
Formula | C40H68O10 |
Category | Glycerolipids [GL] |
Main Class | Glycosyldiradylglycerols [GL05] |
Sub Class | Glycosyldiacylglycerols [GL0501] |
PubChem Compound ID (CID) | - |
InChIKey | CABUYWHYKMEZGE-UJIYXDDXSA-N |
InChI | InChI=1S/C40H68O10/c1-3-5-7-9-11-13-15-16-17-18-19-21-22-24-26-28-35(42)47-31-33 (32-48-40-39(46)38(45)37(44)34(30-41)50-40)49-36(43)29-27-25-23-20-14-12-10-8-6- 4-2/h5,7,11,13,16-17,19,21,33-34,37-41,44-46H,3-4,6,8-10,12,14-15,18,20,22-32H2, 1-2H3/b7-5-,13-11-,17-16-,21-19-/t33-,34-,37+,38?,39?,40-/m1/s1 |
SMILES | C(O[C@@H]1O[C@H](CO)[C@H](O)C(O)C1O)[C@]([H])(OC(CCCCCCCCCCCC)=O)COC(CCCC/C=C\C/ C=C\C/C=C\C/C=C\CC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |