In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10029ABP |
---|---|
Common Name | PA(O-14:0/21:0) |
Systematic Name | 1-tetradecyl-2-heneicosanoyl-sn-glycero-3-phosphate |
Synonyms | PA(O-35:0); PA(O-14:0/21:0) |
Exact Mass | |
Formula | C38H77O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | KDMFKMUKZTWRAZ-DIPNUNPCSA-N |
InChI | InChI=1S/C38H77O7P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-38(39 )45-37(36-44-46(40,41)42)35-43-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h37H,3-36H2 ,1-2H3,(H2,40,41,42)/t37-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCCCCCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |