In-Silico Structure database (LMISSD)
| |
LM ID | LMGP03019AQZ |
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Common Name | PS(15:1(9Z)/18:1(6Z)) |
Systematic Name | 1-(9Z-pentadecenoyl)-2-(6Z-octadecenoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(33:2); PS(15:1_18:1) |
Exact Mass | |
Formula | C39H72NO10P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | Diacylglycerophosphoserines [GP0301] |
PubChem Compound ID (CID) | - |
InChIKey | JOTYSSIAKSKIDZ-AIUOCGCJSA-N |
InChI | InChI=1S/C39H72NO10P/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-38(42)50-35( 33-48-51(45,46)49-34-36(40)39(43)44)32-47-37(41)30-28-26-24-22-20-16-14-12-10-8- 6-4-2/h12,14,21,23,35-36H,3-11,13,15-20,22,24-34,40H2,1-2H3,(H,43,44)(H,45,46)/b 14-12-,23-21-/t35-,36+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCC/C=C\CCCCCCCCCCC)=O)COC(CCCCCCC/C=C\ CCCCC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |