Phosphatidylethanolamine; Glycerol 2-hexadecanoate 1-(10R-methyloctadecanoate) 3-phosphoethanolamine
AlkaPlorer ID: AK310309
Synonym: 3-[[(2-Aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxohexadecyl)oxy]propyl 10-methyloctadecanoate, Tuberculostearoylpalmitoylphosphatidylethanolamine
IUPAC Name: [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] 10-methyloctadecanoate
Structure
SMILES: CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC(C)CCCCCCCC)COP(=O)(O)OCCN
InChI: InChI=1S/C40H80NO8P/c1-4-6-8-10-12-13-14-15-16-17-18-24-28-32-40(43)49-38(36-48-50(44,45)47-34-33-41)35-46-39(42)31-27-23-20-19-22-26-30-37(3)29-25-21-11-9-7-5-2/h37-38H,4-36,41H2,1-3H3,(H,44,45)
InChIKey: DKXLAGNEXVNABN-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mycobacterium tuberculosis | Mycobacterium | Mycobacteriaceae | Mycobacteriales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 734.0530000000001
TPSA？: 134.38000000000002
MolLogP？: 11.52249999999999
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|