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AG00G3NN

845533-86-0 | Bedaquiline (fumarate)

845533-86-0
AG00G3NN
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CAS Number 845533-86-0
Catalog Number AG00G3NN(AGN-PC-0WAK9C)
Chemical Name Bedaquiline (fumarate)
IUPAC Name (1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-naphthalen-1-yl-1-phenylbutan-2-ol;(E)-but-2-enedioic acid
InChI InChI=1S/C32H31BrN2O2.C4H4O4/c1-35(2)19-18-32(36,28-15-9-13-22-10-7-8-14-26(22)28)30(23-11-5-4-6-12-23)27-21-24-20-25(33)16-17-29(24)34-31(27)37-3;5-3(6)1-2-4(7)8/h4-17,20-21,30,36H,18-19H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t30-,32-;/m1./s1
InChI Key ZLVSPMRFRHMMOY-WWCCMVHESA-N
MDL Number MFCD28167761
Molecular Formula C36H35BrN2O6
Molecular Weight 671.5769
SMILES O[C@](CCN(C)C)(C1=C2C=CC=CC2=CC=C1)[C@@H](C3=CC4=CC(Br)=CC=C4N=C3OC)C5=CC=CC=C5.O=C(O)/C=C/C(O)=O
UNII P04QX2C1A5
Synonyms
1-(6-bromo-2-methoxy-quinolin-3-yl)-4-dimethylamino-2-(3-fluorophenyl)-1-phenyl-butan-2-ol, AIDS-222089, AIDS222088, Bedaquiline, bedaquiline fumarate, R207910, TMC207, Bedaquiline fumarate, Bedaquiline (fumarate), Sirturo, 845533-86-0, UNII-P04QX2C1A5, P04QX2C1A5, CHEBI:72295, R403323, Bedaquiline fumarate [USAN], CHEMBL2105700, SCHEMBL20496928, Bedaquiline fumarate; R403323, Bedaquiline fumarate (JAN/USAN), EX-A2647, HY-14881A, CS-2922, AC-28750, D09873, R 403323, R-403323, (1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenylbutan-2-ol bis[(2Z)-but-2-enedioate], 3-Quinolineethanol, 6-bromo-alpha-(2-(dimethylamino)ethyl)-2-methoxy-alpha-1-naphthalenyl- -phenyl-, (S,R)-, (2E)-2-butenedioate (1:1) (salt), 6-bromo-3-[(1R,2S)-4-(dimethylammonio)-2-hydroxy-2-(1-naphthyl)-1-phenylbutyl]-2-methoxyquinolinium (2E)-but-2-enedioate, Sirturo (TN), CS-AN-00009,

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
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    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
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    Reviewed by:Jessie
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    Angene International Limited