EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:89232 - SM(d17:1/24:0)

ChEBI IDCHEBI:89232
ChEBI NameSM(d17:1/24:0)
Stars
DownloadsMolfile
FormulaC46H94N2O6P
Net Charge+1
Average Mass802.240
Monoisotopic Mass801.68440
SMILES[H][C@@](O)(/C=C/CCCCCCCCCCCC)[C@]([H])(COP(=O)(O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C46H93N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-46(50)47-44(43-54-55(51,52)53-42-41-48(3,4)5)45(49)39-37-35-33-31-29-19-17-15-13-11-9-7-2/h37,39,44-45,49H,6-36,38,40-43H2,1-5H3,(H-,47,50,51,52)/p+1/b39-37+/t44-,45+/m0/s1
InChIKeyNBEKBSIOEMQZTN-NMIJJABPSA-O
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
ChEBI Ontology
Outgoing Relation(s)
SM(d17:1/24:0) (CHEBI:89232) is a sphingomyelin (CHEBI:64583)
Synonyms  Source
SPH(d17:1/24:0)HMDB
{[(2S,3R,4E)-3-hydroxy-2-tetracosanamidoheptadec-4-en-1-yl]oxy}[2-(trimethylazaniumyl)ethoxy]phosphinic acidHMDB
Sphingomyelin (d17:1/24:0)HMDB
Manual XrefsDatabases
HMDB0011695HMDB
Citations