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CHEBI:71101 - N-(2-hydroxynonadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine

ChEBI IDCHEBI:71101
ChEBI NameN-(2-hydroxynonadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine
Stars
ASCII NameN-(2-hydroxynonadecanoyl)-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 19 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified16 January 2013
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC42H83NO10
Net Charge0
Average Mass762.123
Monoisotopic Mass761.60170
SMILESCCCCCCCCCCCCCCCCCC(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/C42H83NO10/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-23-26-29-35(46)41(51)43-33(31-52-42-40(50)39(49)38(48)36(30-44)53-42)37(47)34(45)28-25-22-19-17-16-18-21-24-27-32(2)3/h32-40,42,44-50H,4-31H2,1-3H3,(H,43,51)/t33-,34+,35?,36+,37-,38+,39-,40+,42+/m0/s1
InChIKeyMRCDCHVKMFGSTL-DKDGDXTRSA-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-hydroxynonadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:71101) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxynonadecanoyl)-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:71101) 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-hydroxynonadecanoyl)-15-methylhexadecasphinganineChEBI