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CHEBI:224202 - (4E, 8E)-N-2-hydroxyhexadecanoyl-1-O-beta-glucopyranosyl-9-methyl-C18-sphinga-4,8-dienine

ChEBI IDCHEBI:224202
ChEBI Name(4E, 8E)-N-2-hydroxyhexadecanoyl-1-O-beta-glucopyranosyl-9-methyl-C18-sphinga-4,8-dienine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H79NO8
Net Charge0
Average Mass726.093
Monoisotopic Mass725.58057
SMILESCCCCCCCCCCCCCCC(O)C(=O)NC(COC1CC(CO)C(O)C(O)C1O)C(O)/C=C/CC/C=C(\C)CCCCCCCCC
InChIInChI=1S/C42H79NO8/c1-4-6-8-10-12-13-14-15-16-18-20-24-29-37(46)42(50)43-35(32-51-38-30-34(31-44)39(47)41(49)40(38)48)36(45)28-25-21-23-27-33(3)26-22-19-17-11-9-7-5-2/h25,27-28,34-41,44-49H,4-24,26,29-32H2,1-3H3,(H,43,50)/b28-25+,33-27+
InChIKeyCWYKTPKKNCPQTI-YIVLLMPVSA-N
Species of MetaboliteComponentSourceComments
Hypsizygus marmoreus (ncbitaxon:39966) - DOI (10.1002/bms.1200231103)
ChEBI Ontology
Outgoing Relation(s)
(4E, 8E)-N-2-hydroxyhexadecanoyl-1-O-beta-glucopyranosyl-9-methyl-C18-sphinga-4,8-dienine (CHEBI:224202) is a cyclohexanols (CHEBI:23480)
IUPAC Name 
2-hydroxy-N-[(4E,8E)-3-hydroxy-9-methyl-1-[2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxyoctadeca-4,8-dien-2-yl]hexadecanamide
Manual XrefsDatabases
78444228ChemSpider