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CHEBI:71094 - N-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine

ChEBI IDCHEBI:71094
ChEBI NameN-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine
Stars
ASCII NameN-(2-hydroxyoctadecanoyl)-1-O-beta-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine
DefinitionAn N-acyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine in which the acyl group has 18 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified23 November 2012
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC41H81NO10
Net Charge0
Average Mass748.096
Monoisotopic Mass747.58605
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@H](O)CCCCCCCCCCC(C)C
InChIInChI=1S/C41H81NO10/c1-4-5-6-7-8-9-10-11-12-13-14-19-22-25-28-34(45)40(50)42-32(30-51-41-39(49)38(48)37(47)35(29-43)52-41)36(46)33(44)27-24-21-18-16-15-17-20-23-26-31(2)3/h31-39,41,43-49H,4-30H2,1-3H3,(H,42,50)/t32-,33+,34?,35+,36-,37+,38-,39+,41+/m0/s1
InChIKeyUICRDZNPNKWHMQ-YQLQIPRFSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:71094) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyoctadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:71094) is a N-acyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:70814)
Synonym  Source
1-O-β-D-glucosyl-4-hydroxy-N-(2-hydroxyoctadecanoyl)-15-methylhexadecasphinganineChEBI