In-Silico Structure Database (LMISSD)
Common Name
SQDG(35:0/16:0)
Systematic Name
1-pentatriacontanoyl,2-hexadecanoyl-3-(6'-sulfo-α-D-quinovosyl)-sn-glycerol
LM ID
LMGL05019PW2
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1060.818752
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Glycosyldiradylglycerols [GL05]
Glycosyldiacylglycerols [GL0501]
String Representations
InChiKey (Click to copy)
JHZDJDGGGMFOGI-CCOWUYAISA-N
InChi (Click to copy)
InChI=1S/C60H116O12S/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-37-38-40-42-44-46-48-55(61)69-50-53(51-70-60-59(65)58(64)57(63)54(72-60)52-73(66,67)68)71-56(62)49-47-45-43-41-39-36-16-14-12-10-8-6-4-2/h53-54,57-60,63-65H,3-52H2,1-2H3,(H,66,67,68)/t53-,54-,57-,58?,59?,60-/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(CCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O