In-Silico Structure database (LMISSD)
| |
LM ID | LMGP03039DD8 |
---|---|
Common Name | PS(P-14:0/18:2(9Z,12Z)) |
Systematic Name | 1-(1Z-tetradecenyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(P-32:2); PS(P-14:0/18:2) |
Exact Mass | |
Formula | C38H70NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoserines [GP0303] |
PubChem Compound ID (CID) | - |
InChIKey | OVYXGWJHVPVKPM-CFWBRURJSA-N |
InChI | InChI=1S/C38H70NO9P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-37(40)48-35(3 3-46-49(43,44)47-34-36(39)38(41)42)32-45-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h 11,13,17-18,29,31,35-36H,3-10,12,14-16,19-28,30,32-34,39H2,1-2H3,(H,41,42)(H,43, 44)/b13-11-,18-17-,31-29-/t35-,36+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCCC)=O)CO/C=C\CCCCCC CCCCCC)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |