In-Silico Structure database (LMISSD)
| |
LM ID | LMGP03039AFO |
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Common Name | PS(P-16:1(9Z)/18:2(9Z,11Z)) |
Systematic Name | 1-(1Z,9Z-hexadecadienyl)-2-(9Z,11Z-octadecadienoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(P-34:3); PS(P-16:1/18:2) |
Exact Mass | |
Formula | C40H72NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoserines [GP0303] |
PubChem Compound ID (CID) | - |
InChIKey | RYILSKXBDNQGSR-YNGBPRFLSA-N |
InChI | InChI=1S/C40H72NO9P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-39(42)50-37(3 5-48-51(45,46)49-36-38(41)40(43)44)34-47-33-31-29-27-25-23-21-18-16-14-12-10-8-6 -4-2/h13-17,19,31,33,37-38H,3-12,18,20-30,32,34-36,41H2,1-2H3,(H,43,44)(H,45,46) /b15-13-,16-14-,19-17-,33-31-/t37-,38+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCC/C=C\C=C/CCCCCC)=O)CO/C=C\CCCCCC/ C=C\CCCCCC)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |