10beta-Hydroxy 9-O-methylnaltrexone Ethylene Ketal
Product Code
TRC-H805058-25MG
Product Format
Neat
Molecular Formula
C23 H29 N O6
Molecular Weight
415.479
Product Categories
Product Information
Chemical Data
Analyte Name
10beta-Hydroxy 9-O-methylnaltrexone Ethylene Ketal
Molecular Formula
C23 H29 N O6
Molecular Weight
415.479
Accurate Mass
415.199
SMILES
COc1ccc2[C@@H](O)[C@H]3N(CC4CC4)CC[C@@]56[C@@H](Oc1c25)C7(CC[C@@]36O)OCCO7
InChI
InChI=1S/C23H29NO6/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/h4-5,13,17,19-20,25-26H,2-3,6-12H2,1H3/t17-,19-,20-,21+,22-/m1/s1
IUPAC
(4'R,4'aS,7'aR,12'bS,13'R)-3'-(cyclopropylmethyl)-9'-methoxyspiro[1,3-dioxolane-2,7'-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline]-4'a,13'-diol
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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