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CHEBI:233456 - alpha-CMBHC glucuronide

ChEBI IDCHEBI:233456
ChEBI Namealpha-CMBHC glucuronide
Stars
Submittermwilliams
DownloadsMolfile
FormulaC25H36O10
Net Charge0
Average Mass496.553
Monoisotopic Mass496.23085
SMILESCc1c(C)c2c(c(C)c1O[C@H]1O[C@@H](C(=O)O)C(O)[C@@H](O)C1O)CCC(C)(CCCC(C)C(=O)O)O2
InChIInChI=1S/C25H36O10/c1-11(22(29)30)7-6-9-25(5)10-8-15-14(4)19(12(2)13(3)20(15)35-25)33-24-18(28)16(26)17(27)21(34-24)23(31)32/h11,16-18,21,24,26-28H,6-10H2,1-5H3,(H,29,30)(H,31,32)/t11?,16-,17?,18?,21-,24+,25?/m1/s1
InChIKeyDYOFESDCRUIQTB-LPDHOHFDSA-N
ChEBI Ontology
Outgoing Relation(s)
alpha-CMBHC glucuronide (CHEBI:233456) is a lipopolysaccharide (CHEBI:16412)