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CHEBI:172625 - (3S,5R,6S,7E,9x)-7-Megastigmene-3,6,9-triol 9-glucoside

ChEBI IDCHEBI:172625
ChEBI Name(3S,5R,6S,7E,9x)-7-Megastigmene-3,6,9-triol 9-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H34O8
Net Charge0
Average Mass390.473
Monoisotopic Mass390.22537
SMILESCC(/C=C/C1(O)C(C)CC(O)CC1(C)C)OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C19H34O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-17,20-25H,7-9H2,1-4H3/b6-5+
InChIKeyMRPDHXXPDCVBPQ-AATRIKPKSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
(3S,5R,6S,7E,9x)-7-Megastigmene-3,6,9-triol 9-glucoside (CHEBI:172625) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
2-[(E)-4-(1,4-dihydroxy-2,2,6-trimethylcyclohexyl)but-3-en-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
20576635ChemSpider
LMFA13010057LIPID MAPS
LSM-44563LINCS
HMDB0041176HMDB