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Ethyl Morphine 6-beta-D-Glucuronide

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For Research Use Only | Not For Clinical Use
CATAPS168074326
CAS168074-32-6
Structure
IUPAC Name(2S,3S,4S,5R,6R)-6-[[(4R,4aR,7S,7aR,12bS)-9-ethoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Weight489.51
Molecular FormulaC25H31NO9
Canonical SMILESCCOc1ccc2C[C@@H]3[C@@H]4C=C[C@H](O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O)[C@@H]6Oc1c2[C@]46CCN3C
InChIInChI=1S/C25H31NO9/c1-3-32-14-6-4-11-10-13-12-5-7-15(22-25(12,8-9-26(13)2)16(11)20(14)34-22)33-24-19(29)17(27)18(28)21(35-24)23(30)31/h4-7,12-13,15,17-19,21-22,24,27-29H,3,8-10H2,1-2H3,(H,30,31)/t12-,13+,15-,17-,18-,19+,21-,22-,24+,25-/m0/s1
Accurate Mass489.1999
FormatNeat
Size1MG
SubcategoryAnalgesics
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