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CHEBI:173270 - O-Desmethyl-tramado glucuronide

ChEBI IDCHEBI:173270
ChEBI NameO-Desmethyl-tramado glucuronide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H31NO8
Net Charge0
Average Mass425.478
Monoisotopic Mass425.20497
SMILESCN(C)CC1CCCCC1(O)c1cccc(OC2OC(C(=O)O)C(O)C(O)C2O)c1
InChIInChI=1S/C21H31NO8/c1-22(2)11-13-6-3-4-9-21(13,28)12-7-5-8-14(10-12)29-20-17(25)15(23)16(24)18(30-20)19(26)27/h5,7-8,10,13,15-18,20,23-25,28H,3-4,6,9,11H2,1-2H3,(H,26,27)
InChIKeyDSBGQRZOJXSECT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
O-Desmethyl-tramado glucuronide (CHEBI:173270) is a glycoside (CHEBI:24400)
IUPAC Name 
6-[3-[2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0060856HMDB
28551745ChemSpider