Dutasteride Beta-Dimer
Product Code
TRC-D735020
CAS Number
Product Format
Neat
Molecular Formula
C46 H55 F6 N3 O4
Molecular Weight
827.94
API Family
DutasterideProduct Categories
TRC, Impurity Reference Materials , Additional Covid-19 Research materials
Product Type
ImpurityPurity
>95%
Documentation
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Product Information
Chemical Data
Analyte Name
Dutasteride beta-dimer
CAS Number
1648593-70-7
Molecular Formula
C46 H55 F6 N3 O4
Molecular Weight
827.94
Accurate Mass
827.4097
SMILES
C[C@]12CC[C@H]3[C@@H](CC[C@H]4N(C(=O)[C@H]5CC[C@H]6[C@@H]7CC[C@H]8NC(=O)C=C[C@]8(C)[C@H]7CC[C@]56C)C(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(=O)Nc9cc(ccc9C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C46H55F6N3O4/c1-41-19-16-30-26(27(41)9-11-32(41)39(58)53-34-23-24(45(47,48)49)5-8-31(34)46(50,51)52)7-14-36-44(30,4)22-18-38(57)55(36)40(59)33-12-10-28-25-6-13-35-43(3,21-17-37(56)54-35)29(25)15-20-42(28,33)2/h5,8,17-18,21-23,25-30,32-33,35-36H,6-7,9-16,19-20H2,1-4H3,(H,53,58)(H,54,56)/t25-,26-,27-,28-,29-,30-,32+,33+,35+,36+,41-,42-,43+,44+/m0/s1
IUPAC
(1S,3aS,3bS,5aR,9aR,9bS,11aS)-6-[(1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carbonyl]-N-[2,5-bis(trifluoromethyl)phenyl]-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,5,5a,9b,10,11-decahydro-1H-indeno[5,4-f]quinoline-1-carboxamide
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
API Family
Purity
>95%
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