In-Silico Structure Database (LMISSD)
Common Name
PS(30:0/37:0)
Systematic Name
1-triacontanoyl-2-heptatriacontanoyl-sn-glycero-3-phosphoserine
LM ID
LMGP03019E0T
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1226.052787
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
Diacylglycerophosphoserines [GP0301]
String Representations
InChiKey (Click to copy)
DSPKOWBRHQMUNU-DVAGYCIVSA-N
InChi (Click to copy)
InChI=1S/C73H144NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-33-34-35-36-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-72(76)84-69(67-82-85(79,80)83-68-70(74)73(77)78)66-81-71(75)64-62-60-58-56-54-52-50-48-46-44-42-40-38-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h69-70H,3-68,74H2,1-2H3,(H,77,78)(H,79,80)/t69-,70+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(=O)O