In-Silico Structure Database (LMISSD)
Common Name
TG(37:0/39:0/16:0)
Systematic Name
1-heptatriacontanoyl-2-nonatriacontanoyl-3-hexadecanoyl-sn-glycerol
LM ID
LMGL0301K8SG
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1423.424940
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerolipids [GL]
Triradylglycerols [GL03]
Triacylglycerols [GL0301]
String Representations
InChiKey (Click to copy)
OWRWKCZBSOHUEE-QSLFSIBPSA-N
InChi (Click to copy)
InChI=1S/C95H186O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-35-37-39-41-43-45-47-48-50-52-54-56-58-60-62-64-66-68-71-74-77-80-83-86-89-95(98)101-92(90-99-93(96)87-84-81-78-75-72-69-24-21-18-15-12-9-6-3)91-100-94(97)88-85-82-79-76-73-70-67-65-63-61-59-57-55-53-51-49-46-44-42-40-38-36-34-32-30-28-26-23-20-17-14-11-8-5-2/h92H,4-91H2,1-3H3/t92-/m0/s1
SMILES (Click to copy)
C(OC(=O)CCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O