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CHEBI:225349 - 1-O-TBSA-2-O-palmitoyl-sn-phospholipid

ChEBI IDCHEBI:225349
ChEBI Name1-O-TBSA-2-O-palmitoyl-sn-phospholipid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H80NO8P
Net Charge0
Average Mass734.053
Monoisotopic Mass733.56216
SMILESCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC[C@H](C)CCCCCCCC)COP(=O)(O)OCCN
InChIInChI=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)/t37-,38-/m1/s1
InChIKeyDKXLAGNEXVNABN-XPSQVAKYSA-N
Species of MetaboliteComponentSourceComments
Mycobacterium tuberculosis (ncbitaxon:1773) - PubMed (19965610)
ChEBI Ontology
Outgoing Relation(s)
1-O-TBSA-2-O-palmitoyl-sn-phospholipid (CHEBI:225349) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] (10R)-10-methyloctadecanoate
Manual XrefsDatabases
LMGP02010357LIPID MAPS
24842046ChemSpider