Compound: Morphine-6-glucuronide
SMILES: O=C(O)[C@H]1O[C@@H](O[C@H]2C=C[C@H]3[C@@H]4N(C)CC[C@@]53[C@H]2Oc6c(O)ccc(c56)C4)[C@H](O)[C@H]([C@@H]1O)O
InChIKey: GNJCUHZOSOYIEC-GAROZEBRSA-N
Synonyms: Morphine-6-glucuronide, Morphine 6-glucuronide, MORPHINE GLUCURONIDE, 20290-10-2, Morphine 6-beta-D-glucopyranosiduronide, Morphine glucuronide, (-)-, 64Y9KYM60R, glucuronido de morfina, glucuronide de morphine, DTXSID40174158, Morphine 6-beta-D-Glucuronide, beta-D-Glucopyranosiduronic acid, (5alpha,6alpha)-7,8-didehydro-4,5-epoxy-3-hydroxy-17-methylmorphinan-6-yl, morphine-6beta-glucuronide, (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(((1S,5R,13R,14S,17R)-10-hydroxy-4-methyl-12-oxa-4-azapentacyclo(9.6.1.0^(1,13).0^(5,17).0^(7,18))octadeca-7(18),8,10,15-tetraen-14-yl)oxy)oxane-2-carboxylic acid, (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(1S,5R,13R,14S,17R)-10-hydroxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10,15-tetraen-14-yl]oxy}oxane-2-carboxylic acid, (2S,3S,4S,5R,6R)-6-(((4R,4aR,7S,7aR,12bS)-9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro(3,2-e)isoquinolin-7-yl)oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid, (2S,3S,4S,5R,6R)-6-[[(4R,4aR,7S,7aR,12bS)-9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid, morphini glucuronidum, RefChem:159759, DTXCID0096649, DTXCID001769508, DTXSID501340022, Morphine glucuronide [INN], morphine-6-beta-d-glucuronide, Morphine 6-b-D-Glucuronide, CHEBI:80581, Morphine 6-.beta.-d-glucuronide, MORPHINE 6-GLUCURONIDE(MINOR), UNII-64Y9KYM60R, Morphine 6-beta-D-Glucuronide (100?g/ml in Methanol:Water), Morphine 6-b-D-Glucuronide (1.0 mg/mL in Water:Methanol 80:20), GNJCUHZOSOYIEC-GAROZEBRSA-N, morphine-glucuronide, Morphine 6-beta-glucuronide, CHEMBL1330, Epitope ID:2270998, Morfina 6beta- D-Glucuronide, SCHEMBL152647, .beta.-D-Glucopyranosiduronic acid, (5.alpha.,6.alpha.)-7,8-didehydro-4,5-epoxy-3-hydroxy-17-methylmorphinan-6-yl, BDBM50370478, PDSP2_000436, DB06409, Glucopyranosiduronic acid, 7,8-didehydro-4,5-alpha-epoxy-3-hydroxy-17-methylmorphinan-6-alpha-yl-, beta-D-, NS00010465, Morphine 6-beta-D-Glucuronide 0.1 mg/ml in Water, Morphine 6-beta-D-Glucuronide 1.0 mg/ml in Water, Q4303469, Morphine-6-Beta-D-glucuronide, 1mg/ml in Acetonitrile/Water : 1/1, Morphine 6-beta-D-Glucuronide (1.0 mg/mL in Water:Methanol 80:20), 3-Hydroxy-17-methyl-5alpha-7,8-didehydro-4,5-epoxymorphinan-6alpha-yl beta-D-glucopyranosiduronic acid
Theoretical properties:
molecular_formula: C23H27NO9
molecular_weight: 461.5 g/mol
exact_mass: 461.16858144 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 5
hydrogen_bond_acceptor_count: 10
rotatable_bond_count: 3
heavy_atom_count: 33
topological_polar_surface_area: 149 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Morphine-6-glucuronide is a morphinane alkaloid.
chembl: MORPHINE GLUCURONIDE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Morphine-6-glucuronide (M6G) is a major active metabolite of morphine. M6G is formed from morphine by the enzyme UGT2B7. It has analgesic effects roughly half that of morphine. M6G can accumulate to toxic levels in kidney failure.