EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:71085 - N-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine

ChEBI IDCHEBI:71085
ChEBI NameN-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine
Stars
ASCII NameN-(2-hydroxyoctadecanoyl)-1-O-beta-D-glucosyl-15-methylhexadecasphing-4-enine
DefinitionAn N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine in which the acyl group has 18 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified23 November 2012
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC41H79NO9
Net Charge0
Average Mass730.081
Monoisotopic Mass729.57548
SMILESCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C41H79NO9/c1-4-5-6-7-8-9-10-11-12-13-16-20-23-26-29-35(45)40(49)42-33(31-50-41-39(48)38(47)37(46)36(30-43)51-41)34(44)28-25-22-19-17-14-15-18-21-24-27-32(2)3/h25,28,32-39,41,43-48H,4-24,26-27,29-31H2,1-3H3,(H,42,49)/b28-25+/t33-,34+,35?,36+,37+,38-,39+,41+/m0/s1
InChIKeyNVEDLCIMJZUQOI-GUFZRRBGSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71085) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71085) is a N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:70815)
Synonym  Source
1-O-β-D-glucosyl-N-(2-hydroxyoctadecanoyl)-15-methylhexadecasphing-4-enineChEBI