In-Silico Structure database (LMISSD)
| |
LM ID | LMGL05019K6A |
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Common Name | SQDG(14:0/12:0) |
Systematic Name | 1-tetradecanoyl,2-dodecanoyl-3-(6'-sulfo-α-D-quinovosyl)-sn-glycerol |
Synonyms | SQDG(26:0); SQDG(12:0_14:0) |
Exact Mass | |
Formula | C35H66O12S |
Category | Glycerolipids [GL] |
Main Class | Glycosyldiradylglycerols [GL05] |
Sub Class | Glycosyldiacylglycerols [GL0501] |
PubChem Compound ID (CID) | - |
InChIKey | TXGKETSTNYNPRF-SMEQHYCESA-N |
InChI | InChI=1S/C35H66O12S/c1-3-5-7-9-11-13-14-16-17-19-21-23-30(36)44-25-28(46-31(37)2 4-22-20-18-15-12-10-8-6-4-2)26-45-35-34(40)33(39)32(38)29(47-35)27-48(41,42)43/h 28-29,32-35,38-40H,3-27H2,1-2H3,(H,41,42,43)/t28-,29-,32-,33?,34?,35-/m1/s1 |
SMILES | C(O[C@@H]1O[C@H](CS(=O)(O)=O)[C@@H](O)C(O)C1O)[C@]([H])(OC(CCCCCCCCCCC)=O)COC(CC CCCCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |