In-Silico Structure database (LMISSD)
| |
LM ID | LMGP03029AA7 |
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Common Name | PS(O-14:0/18:4(9E,11E,13E,15E)) |
Systematic Name | 1-tetradecyl-2-(9E,11E,13E,15E-octadecatetraenoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(O-32:4); PS(O-14:0/18:4) |
Exact Mass | |
Formula | C38H68NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | 1-alkyl,2-acylglycerophosphoserines [GP0302] |
PubChem Compound ID (CID) | - |
InChIKey | FOLJHYHXNXEMKX-JIUNVVOGSA-N |
InChI | InChI=1S/C38H68NO9P/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 5,7,9,11,13,15,17-18,35-36H,3-4,6,8,10,12,14,16,19-34,39H2,1-2H3,(H,41,42)(H,43, 44)/b7-5+,11-9+,15-13+,18-17+/t35-,36+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCC/C=C/C=C/C=C/C=C/CC)=O)COCCCCCCCC CCCCCC)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |