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CHEBI:71140 - N-(2-hydroxyhexacosanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine

ChEBI IDCHEBI:71140
ChEBI NameN-(2-hydroxyhexacosanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine
Stars
ASCII NameN-(2-hydroxyhexacosanoyl)-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 26 carbons and 0 double bonds and is 2-hydroxylated.
Last Modified23 November 2012
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC49H95NO9
Net Charge0
Average Mass842.297
Monoisotopic Mass841.70068
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(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/C49H95NO9/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-28-31-34-37-43(53)48(57)50-41(39-58-49-47(56)46(55)45(54)44(38-51)59-49)42(52)36-33-30-27-25-22-23-26-29-32-35-40(2)3/h33,36,40-47,49,51-56H,4-32,34-35,37-39H2,1-3H3,(H,50,57)/b36-33+/t41-,42+,43?,44+,45+,46-,47+,49+/m0/s1
InChIKeyFIWWQKHPXWCNEV-YBWUOHGMSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-hydroxyhexacosanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71140) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-(2-hydroxyhexacosanoyl)-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71140) is a N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:70815)
Synonym  Source
1-O-β-D-glucosyl-N-(2-hydroxyhexacosanoyl)-15-methylhexadecasphing-4-enineChEBI