Bedaquiline (fuMarate) structure, CAS 845533-86-0

Bedaquiline (fuMarate)

CAS Number845533-86-0

SynonymsSirturo; bedaquiline fumarate; Bedaquiline (fumarate)

Molecular FormulaC36H35BrN2O6

Molecular Weight671.577

Purity98.00%

Density

Boiling Point

Melting Point

Flash Point

Appearancepowder

EINECS

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Symbol

Signal Word

Cat. No.: 2A-1171112 Purity: 98.00%
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Quality Control of [ 845533-86-0 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number845533-86-0
Catalog No.2A-1171112
Chinese Name贝达喹啉富马酸盐
SynonymsSirturo; bedaquiline fumarate; Bedaquiline (fumarate)
Molecular FormulaC36H35BrN2O6
Molecular Weight671.577
Purity98.00
Appearancepowder
Storage Condition-20℃
ApplicationBedaquiline fumarate is a diarylquinoline antibiotic that acts on ATP synthase and is commonly used to treat Mycobacterium tuberculosis infections.
PubChem ID49811845
SMILESCOc1nc2ccc(Br)cc2cc1C(c1ccccc1)C(O)(CCN(C)C)c1cccc2ccccc12.O=C(O)C=CC(=O)O
InChIInChI=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 KeyZLVSPMRFRHMMOY-WWCCMVHESA-N
Transport InfoProduct name: Bedaquiline fumarate
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