8-Hydroxy Mirtazapine Beta-D-Glucuronide 90%

cas: 155239-47-7 — see every product listed under this CAS number, including other names

8-Hydroxy Mirtazapine Beta-D-Glucuronide 90% (CAS 155239-47-7) is a chemical reagent available from Chemat. Available pack sizes: 1mg. Offered by: TRC.

brandTRC
catalog numberTRC-H948455-1MG
cas155239-47-7
size1mg
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Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(5-methyl-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaen-17-yl)oxy]oxane-2-carboxylic acid (CAS 155239-47-7) is a chemical compound with the molecular formula C23H27N3O7 and a molecular weight of 457.5 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(5-methyl-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaen-17-yl)oxy]oxane-2-carboxylic acid. InChIKey: DSOPOPYPJYTAKL-IKIJYXEQSA-N.

Identity
Molecular formulaC23H27N3O7
Molecular weight457.5 g/mol
IUPAC name(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(5-methyl-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaen-17-yl)oxy]oxane-2-carboxylic acid
InChIKeyDSOPOPYPJYTAKL-IKIJYXEQSA-N
SMILESCN1CCN2C(C1)C3=CC=CC=C3CC4=C2N=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: 8-Hydroxy Mirtazapine b-D-Glucuronide 90%, 8-Hydroxymirtazapine beta-D-glucuronide, 8-Hydroxy Mirtazapine ?-D-Glucuronide 90%, 8-Hydroxy Mirtazapine beta-D-Glucuronide 90per cent
Isomers (same molecular formula)
(4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide C23H27N3O7
(4R,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide C23H27N3O7
(4S,4aR,5aR,12aR)-4-(dimethylamino)-7-(ethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide C23H27N3O7
(4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid C23H27N3O7
(4aR,6S,7S,8R,8aR)-6-(2-azidoethoxy)-8-[(4-methoxyphenyl)methoxy]-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol C23H27N3O7
(2S)-2-[[4-[2-[4-[(1S)-1,2-dihydroxyethyl]phenyl]ethynyl]benzoyl]-methylamino]-N-hydroxy-N',2-dimethylpropanediamide;hydrate C23H27N3O7

Also listed as

8-Hydroxymirtazapine b-D-glucuronide Biosynth CAS 155239-47-7