N-Desmethyl Asenapine N-Carbamoyl Glucuronide
Product Code
TRC-D290735-25MG
CAS Number
Product Format
Neat
Molecular Formula
C23 H22 Cl N O9
Molecular Weight
491.875
Product Categories
Product Information
Chemical Data
Analyte Name
N-Desmethyl Asenapine N-Carbamoyl Glucuronide
CAS Number
128923-28-4
Molecular Formula
C23 H22 Cl N O9
Molecular Weight
491.875
Accurate Mass
491.098
SMILES
O[C@@H]1[C@@H](O)[C@H](OC(=O)N2C[C@@H]3[C@@H](C2)c4cc(Cl)ccc4Oc5ccccc35)O[C@@H]([C@H]1O)C(=O)O
InChI
InChI=1S/C23H22ClNO9/c24-10-5-6-16-12(7-10)14-9-25(8-13(14)11-3-1-2-4-15(11)32-16)23(31)34-22-19(28)17(26)18(27)20(33-22)21(29)30/h1-7,13-14,17-20,22,26-28H,8-9H2,(H,29,30)/t13-,14-,17-,18-,19+,20-,22-/m0/s1
IUPAC
(2S,3S,4S,5R,6S)-6-[(2R,6R)-9-chloro-13-oxa-4-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),7,9,11,15,17-hexaene-4-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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