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CHEBI:71135 - N-pentacosanoyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine

ChEBI IDCHEBI:71135
ChEBI NameN-pentacosanoyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine
Stars
ASCII NameN-pentacosanoyl-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 25 carbons and 0 double bonds.
Last Modified23 November 2012
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC48H95NO9
Net Charge0
Average Mass830.286
Monoisotopic Mass829.70068
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(=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/C48H95NO9/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30-33-36-43(52)49-40(38-57-48-47(56)46(55)45(54)42(37-50)58-48)44(53)41(51)35-32-29-26-24-23-25-28-31-34-39(2)3/h39-42,44-48,50-51,53-56H,4-38H2,1-3H3,(H,49,52)/t40-,41+,42+,44-,45+,46-,47+,48+/m0/s1
InChIKeyXLLSVCIMLLUNKQ-CCPUTPORSA-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-pentacosanoyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:71135) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-pentacosanoyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:71135) is a N-acyl-1-O-β-D-glucosyl-4-hydroxy-15-methylhexadecasphinganine (CHEBI:70814)
Synonym  Source
1-O-β-D-glucosyl-4-hydroxy-15-methyl-N-pentacosanoylhexadecasphinganineChEBI