In-Silico Structure Database (LMISSD)
Common Name
LPS(0:0/20:4(5Z,8Z,11Z,13E))
Systematic Name
2-(5Z,8Z,11Z,13E-eicosatetraenoyl)-sn-glycero-3-phosphoserine
LM ID
LMGP03059ADV
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
545.275372
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
Monoacylglycerophosphoserines [GP0305]
String Representations
InChiKey (Click to copy)
AVPXSGYXLWQVTH-JLMGEAPOSA-N
InChi (Click to copy)
InChI=1S/C26H44NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(29)36-23(20-28)21-34-37(32,33)35-22-24(27)26(30)31/h7-10,12-13,15-16,23-24,28H,2-6,11,14,17-22,27H2,1H3,(H,30,31)(H,32,33)/b8-7+,10-9-,13-12-,16-15-/t23-,24+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCC/C=CC/C=CC/C=CC=CCCCCCC)=O)CO)(=O)O