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Hydromorphone-3-glucuronide

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For Research Use Only | Not For Clinical Use
CATAPS40505768
CAS40505-76-8
Structure
IUPAC Name(2S,3S,4S,5R,6S)-6-[[(4R,4aR,7aR,12bS)-3-methyl-7-oxo-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-9-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Weight461.46
Molecular FormulaC23H27NO9
Canonical SMILESCN1CC[C@@]23[C@H]4CCC(=O)[C@@H]2Oc5c(O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)ccc(C[C@@H]14)c35
InChIInChI=1S/C23H27NO9/c1-24-7-6-23-10-3-4-12(25)20(23)32-18-13(5-2-9(14(18)23)8-11(10)24)31-22-17(28)15(26)16(27)19(33-22)21(29)30/h2,5,10-11,15-17,19-20,22,26-28H,3-4,6-8H2,1H3,(H,29,30)/t10-,11+,15-,16-,17+,19-,20-,22+,23-/m0/s1
Accurate Mass461.1686
FormatNeat
Product TypeMetabolite
ShippingRoom Temperature
Size5MG
Storage Conditions-20°C Freezer
SubcategoryChiral molecules, Analgesics
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