In-Silico Structure Database (LMISSD)
Common Name
SQDG(15:1(9Z)/14:1(9Z))
Systematic Name
1-(9Z-pentadecenoyl),2-(9Z-tetradecenoyl)-3-(6'-sulfo-α-D-quinovosyl)-sn-glycerol
LM ID
LMGL05019LDA
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
748.443152
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
BPQOAAVOMMFFEU-GNQSPSMESA-N
InChi (Click to copy)
InChI=1S/C38H68O12S/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-33(39)47-28-31(49-34(40)27-25-23-21-19-16-14-12-10-8-6-4-2)29-48-38-37(43)36(42)35(41)32(50-38)30-51(44,45)46/h10-13,31-32,35-38,41-43H,3-9,14-30H2,1-2H3,(H,44,45,46)/b12-10-,13-11-/t31-,32-,35-,36?,37?,38-/m1/s1
SMILES (Click to copy)
C(O[C@@H]1O[C@H](CS(=O)(O)=O)[C@@H](O)C(O)C1O)[C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)COC(CCCCCCC/C=C\CCCCC)=O