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CHEBI:74210 - N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine

ChEBI IDCHEBI:74210
ChEBI NameN-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine
Stars
ASCII NameN-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine
DefinitionA N-acyl-4-hydroxy-15-methylhexadecasphinganine in which the acyl group has 27 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified9 January 2014
Submitterabridge
DownloadsMolfile
FormulaC44H89NO5
Net Charge0
Average Mass712.198
Monoisotopic Mass711.67407
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
InChIInChI=1S/C44H89NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-31-34-37-42(48)44(50)45-40(38-46)43(49)41(47)36-33-30-27-25-24-26-29-32-35-39(2)3/h39-43,46-49H,4-38H2,1-3H3,(H,45,50)/t40-,41+,42?,43-/m0/s1
InChIKeySOZGTHPKFFKIBN-YIWOKQJZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine (CHEBI:74210) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine (CHEBI:74210) is a N-acyl-15-methylhexadecaphytosphingosine (CHEBI:71234)
IUPAC Name 
2-hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-15-methylhexadecan-2-yl]heptacosanamide
Synonym  Source
N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecadihydrosphingosineSUBMITTER