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CHEBI:74207 - N-(2-hydroxypentacosanoyl)-4-hydroxy-15-methylhexadecasphinganine

ChEBI IDCHEBI:74207
ChEBI NameN-(2-hydroxypentacosanoyl)-4-hydroxy-15-methylhexadecasphinganine
Stars
ASCII NameN-(2-hydroxypentacosanoyl)-4-hydroxy-15-methylhexadecasphinganine
DefinitionA N-acyl-4-hydroxy-15-methylhexadecasphinganine in which the acyl group has 25 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified9 January 2014
Submitterabridge
DownloadsMolfile
FormulaC42H85NO5
Net Charge0
Average Mass684.144
Monoisotopic Mass683.64277
SMILESCCCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
InChIInChI=1S/C42H85NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-29-32-35-40(46)42(48)43-38(36-44)41(47)39(45)34-31-28-25-23-22-24-27-30-33-37(2)3/h37-41,44-47H,4-36H2,1-3H3,(H,43,48)/t38-,39+,40?,41-/m0/s1
InChIKeyGNOKGRKXCDIDQM-KGXKBISVSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxypentacosanoyl)-4-hydroxy-15-methylhexadecasphinganine (CHEBI:74207) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxypentacosanoyl)-4-hydroxy-15-methylhexadecasphinganine (CHEBI:74207) is a N-acyl-15-methylhexadecaphytosphingosine (CHEBI:71234)
IUPAC Name 
2-hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-15-methylhexadecan-2-yl]pentacosanamide
Synonym  Source
N-(2-hydroxypentacosanoyl)-4-hydroxy-15-methylhexadecahydrosphingosineSUBMITTER