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CHEBI:74211 - N-(2-hydroxyoctacosanoyl)-4-hydroxy-15-methylhexadecasphinganine

ChEBI IDCHEBI:74211
ChEBI NameN-(2-hydroxyoctacosanoyl)-4-hydroxy-15-methylhexadecasphinganine
Stars
ASCII NameN-(2-hydroxyoctacosanoyl)-4-hydroxy-15-methylhexadecasphinganine
DefinitionA N-acyl-4-hydroxy-15-methylhexadecasphinganine in which the acyl group has 28 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified9 January 2014
Submitterabridge
DownloadsMolfile
FormulaC45H91NO5
Net Charge0
Average Mass726.225
Monoisotopic Mass725.68973
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
InChIInChI=1S/C45H91NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-29-32-35-38-43(49)45(51)46-41(39-47)44(50)42(48)37-34-31-28-26-25-27-30-33-36-40(2)3/h40-44,47-50H,4-39H2,1-3H3,(H,46,51)/t41-,42+,43?,44-/m0/s1
InChIKeyYRNOVULYPNDYPF-GJMRQECBSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyoctacosanoyl)-4-hydroxy-15-methylhexadecasphinganine (CHEBI:74211) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyoctacosanoyl)-4-hydroxy-15-methylhexadecasphinganine (CHEBI:74211) is a N-acyl-15-methylhexadecaphytosphingosine (CHEBI:71234)
IUPAC Name 
2-hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-15-methylhexadecan-2-yl]octacosanamide
Synonym  Source
N-(2-hydroxyoctacosanoyl)-4-hydroxy-15-methylhexadecadihydrosphingosineSUBMITTER