In-Silico Structure database (LMISSD)
| |
LM ID | LMGP03029AJO |
---|---|
Common Name | PS(O-16:1(9Z)/15:0) |
Systematic Name | 1-(9Z-hexadecenyl)-2-pentadecanoyl-sn-glycero-3-phosphoserine |
Synonyms | PS(O-31:1); PS(O-16:1/15:0) |
Exact Mass | |
Formula | C37H72NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | 1-alkyl,2-acylglycerophosphoserines [GP0302] |
PubChem Compound ID (CID) | - |
InChIKey | IRDUHZNAIRWKGV-NUZFNMCPSA-N |
InChI | InChI=1S/C37H72NO9P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-44-31-34(32-45-4 8(42,43)46-33-35(38)37(40)41)47-36(39)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h13, 15,34-35H,3-12,14,16-33,38H2,1-2H3,(H,40,41)(H,42,43)/b15-13-/t34-,35+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCC)=O)COCCCCCCCC/C=C\CCCCCC) (=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |