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CHEBI:175801 - 4-Hydroxyretinoic acid glucuronide

ChEBI IDCHEBI:175801
ChEBI Name4-Hydroxyretinoic acid glucuronide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H36O9
Net Charge0
Average Mass492.565
Monoisotopic Mass492.23593
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)O)C(C)(C)CCC1OC1OC(C(=O)O)C(O)C(O)C1O
InChIInChI=1S/C26H36O9/c1-14(7-6-8-15(2)13-19(27)28)9-10-17-16(3)18(11-12-26(17,4)5)34-25-22(31)20(29)21(30)23(35-25)24(32)33/h6-10,13,18,20-23,25,29-31H,11-12H2,1-5H3,(H,27,28)(H,32,33)/b8-6+,10-9+,14-7+,15-13+
InChIKeyLVCMXFSJTNPFHH-FRCNGJHJSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Hydroxyretinoic acid glucuronide (CHEBI:175801) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
6-[3-[(1E,3E,5E,7E)-8-carboxy-3,7-dimethylocta-1,3,5,7-tetraenyl]-2,4,4-trimethylcyclohex-2-en-1-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0061688HMDB