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CHEBI:74177 - N-henicosanoyl-15-methylhexadecasphinganine

ChEBI IDCHEBI:74177
ChEBI NameN-henicosanoyl-15-methylhexadecasphinganine
Stars
ASCII NameN-henicosanoyl-15-methylhexadecasphinganine
DefinitionA N-acyl-15-methylhexadecasphinganine in which the acyl group has 21 carbons and 0 double bonds.
Last Modified4 April 2014
Submitterabridge
DownloadsMolfile
FormulaC38H77NO3
Net Charge0
Average Mass596.038
Monoisotopic Mass595.59035
SMILESCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCC(C)C
InChIInChI=1S/C38H77NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-27-30-33-38(42)39-36(34-40)37(41)32-29-26-23-20-18-19-22-25-28-31-35(2)3/h35-37,40-41H,4-34H2,1-3H3,(H,39,42)/t36-,37+/m0/s1
InChIKeyCJMKCLZPGYCFBD-PQQNNWGCSA-N
ChEBI Ontology
Outgoing Relation(s)
N-henicosanoyl-15-methylhexadecasphinganine (CHEBI:74177) is a N-acyl-15-methylhexadecasphinganine (CHEBI:70845)
IUPAC Name 
N-[(2S,3R)-1,3-dihydroxy-15-methylhexadecan-2-yl]henicosanamide
Synonym  Source
N-henicosanoyl-15-methylhexadecadihydrosphingosineSUBMITTER