In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20049EQC |
---|---|
Common Name | PS(O-16:0/4:1(3E)) |
Systematic Name | 1-hexadecyl-2-3E-butenoyl-sn-glycero-3-phosphoserine |
Synonyms | PS(O-20:1); PS(O-16:0/4:1) |
Exact Mass | |
Formula | C26H50NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoserines [GP2004] |
PubChem Compound ID (CID) | - |
InChIKey | JSZZWBZZBDMZMM-RPWUZVMVSA-N |
InChI | InChI=1S/C26H50NO9P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-33-20-23(36-25(28) 18-4-2)21-34-37(31,32)35-22-24(27)26(29)30/h4,23-24H,2-3,5-22,27H2,1H3,(H,29,30) (H,31,32)/t23-,24+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CC=C)=O)COCCCCCCCCCCCCCCCC)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |