In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10029AJ3 |
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Common Name | PA(O-16:1(9Z)/18:1(7Z)) |
Systematic Name | 1-(9Z-hexadecenyl)-2-(7Z-octadecenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-34:2); PA(O-16:1/18:1) |
Exact Mass | |
Formula | C37H71O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | AFOKLXJSIWPYPO-QUNRZUQMSA-N |
InChI | InChI=1S/C37H71O7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-37(38)44-36(35 -43-45(39,40)41)34-42-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16,20,22,3 6H,3-13,15,17-19,21,23-35H2,1-2H3,(H2,39,40,41)/b16-14-,22-20-/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCC/C=C\CCCCCCCCCC)=O)COCCCCCCCC/C=C\CCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |