EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:90008 - SM(d18:0/16:1(9Z))

ChEBI IDCHEBI:90008
ChEBI NameSM(d18:0/16:1(9Z))
Stars
DownloadsMolfile
FormulaC39H79N2O6P
Net Charge0
Average Mass703.043
Monoisotopic Mass702.56757
SMILESCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@H](O)CCCCCCCCCCCCCCC
InChIInChI=1S/C39H79N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-38(42)37(36-47-48(44,45)46-35-34-41(3,4)5)40-39(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h17,19,37-38,42H,6-16,18,20-36H2,1-5H3,(H-,40,43,44,45)/b19-17-/t37-,38+/m0/s1
InChIKeyCGVOQSQIYSUXAT-PPLFXBRHSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
urine (BTO:0001419) PubMed (24023812)
saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
cerebrospinal fluid (UBERON:0001359) PubMed (22546835)
ChEBI Ontology
Outgoing Relation(s)
SM(d18:0/16:1(9Z)) (CHEBI:90008) is a sphingomyelin (CHEBI:64583)
Synonyms  Source
N-(15Z-Tetracosenoyl)-sphing-4-enine-1-phosphocholineHMDB
C16:1 SphingomyelinHMDB
(2-{[(2S,3R)-2-[(9Z)-hexadec-9-enamido]-3-hydroxyoctadecyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
Manual XrefsDatabases
HMDB0013464HMDB
SphingomyelinWikipedia
Citations