In-Silico Structure database (LMISSD)
| |
LM ID | LMGL05019AH0 |
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Common Name | MGDG(13:0/18:2(9Z,12Z)) |
Systematic Name | 1-tridecanoyl,2-(9Z,12Z-octadecadienoyl)-3-3-O-β-D-galactosyl-sn-glycerol |
Synonyms | MGDG(31:2); MGDG(13:0_18:2) |
Exact Mass | |
Formula | C40H72O10 |
Category | Glycerolipids [GL] |
Main Class | Glycosyldiradylglycerols [GL05] |
Sub Class | Glycosyldiacylglycerols [GL0501] |
PubChem Compound ID (CID) | - |
InChIKey | HXYXPSJOCYIZPU-TXWRIJBOSA-N |
InChI | InChI=1S/C40H72O10/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-36(43)49-33(32 -48-40-39(46)38(45)37(44)34(30-41)50-40)31-47-35(42)28-26-24-22-20-14-12-10-8-6- 4-2/h11,13,16-17,33-34,37-41,44-46H,3-10,12,14-15,18-32H2,1-2H3/b13-11-,17-16-/t 33-,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(CCCCCCC/C=C\C/C=C\CCCCC)=O)COC( CCCCCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |