10-Oxo 9-O-methylnaltrexone Ethylene Ketal
Product Code
TRC-O857505-25MG
Product Format
Neat
Molecular Formula
C23 H27 N O6
Molecular Weight
413.464
Product Categories
Product Information
Chemical Data
Analyte Name
10-Oxo 9-O-methylnaltrexone Ethylene Ketal
Molecular Formula
C23 H27 N O6
Molecular Weight
413.464
Accurate Mass
413.184
SMILES
COc1ccc2C(=O)[C@H]3N(CC4CC4)CC[C@@]56[C@@H](Oc1c25)C7(CC[C@@]36O)OCCO7
InChI
InChI=1S/C23H27NO6/c1-27-15-5-4-14-16-18(15)30-20-21(16)8-9-24(12-13-2-3-13)19(17(14)25)22(21,26)6-7-23(20)28-10-11-29-23/h4-5,13,19-20,26H,2-3,6-12H2,1H3/t19-,20-,21+,22-/m1/s1
IUPAC
(4S,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a-hydroxy-9-methoxyspiro[1,2,4,5,6,7a-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7,2'-1,3-dioxolane]-13-one
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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