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85081-18-1 (NBI-98782)

1

Identification

NBI-98782 NBI-98782
Name NBI-98782
Formula C19H29NO3
MW 319.44
CAS No. 85081-18-1
EINECS
Smiles O[[email protected]]1[[email protected]](CC(C)C)CN2CCC3=CC(OC)=C(OC)C=C3[[email protected]@]2([H])C1
Synonyms (2R,3R,11bR)-3-isobutyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-pyrido[2,1-a]isoquinolin-2-ol
InChI InChI=1S/C19H29NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16-17,21H,5-7,10-11H2,1-4H3/t14-,16-,17-/m1/s1
2

Introduction

NBI-98782(alpha-dihydrotetrabenazine) is a vesicular monoamine transporter (VMAT2) inhibtior with an Ki value of 0.97 nM. IC50 value: 0.97± 0.48 nM [1] Target: VMAT2 The (+)-isomer showed high affinity in vitro (Ki = 0.97 +/- 0.48 nM) for the vesicular monoamine transporter (VMAT2) in rat brain striatum, whereas the (-)-isomer was inactive (Ki = 2.2 +/- 0.3 microM).

Background Information

3

Protocol(Only for Reference)

Cell Experiment

Animal Experiment

4

Physical and Chemical Properties

Appearance:White to off-white Solid EBNumber:EB000012975

Storage condition

Solubility

DMSO by MedChemexpress Co., Ltd.
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Mechanism and Indication

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Clinical Information

Product Name Sponsor & Collaborators Indications Start Date End Date Phase
NBI-98782 Neurocrine Biosciences Inc Tardive dyskinesia 2012/12/31 2013/8/31 Phase 2 Clinical
NBI-98782 Neurocrine Biosciences Inc Tardive dyskinesia 2012/9/30 2013/10/31 Phase 2 Clinical
NBI-98782 Neurocrine Biosciences Inc Tardive dyskinesia 2011/1/31 2011/3/31 Phase 2 Clinical
NBI-98782 Neurocrine Biosciences Inc Tardive dyskinesia 2011/8/31 2012/2/29 Phase 2 Clinical
NBI-98782 Neurocrine Biosciences Inc Hepatic insufficiency 2013/8/31 2014/3/31 Phase 1 Clinical
NBI-98782 Neurocrine Biosciences Inc 2013/7/31 2013/8/31 Phase 1 Clinical
NBI-98782 - No Development Reported
7

Safety Data of NBI-98782

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Spectral Information

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Suppliers List

Company Price and Availability Country/Region
Acanthus Research USA
Apexbio Technology LLC 5mg/USD333() USA
BOC Sciences
CHEMSCENE, LLC 5mg/USD420();10mg/USD600() USA
MedChemexpress Co., Ltd. 5mg/USD420();10mg/USD600() USA
Shanghai Haoyuan Chemexpress Co., Ltd. 5mg/USD420();10mg/USD600() China
10

Related Products

Other Forms of 85081-18-1

Name CAS No Formula MW
NBI-98854 171598-74-6 C19H29NO3 319.44

Recommended Compounds in Monoamine Transporter

Name CAS No Formula MW
Tetrabenazine (Racemate) 718635-93-9 C19H27NO3 317.4226
NBI-98854 171598-74-6 C19H29NO3 319.44
Reserpine (hydrochloride) 16994-56-2 C33H41ClN2O9 645.14
Reserpine 50-55-5 C33H40N2O9 608.68
Tetrabenazine ((+)-) 1026016-83-0 C19H27NO3 317.4226
Corticosterone 50-22-6 C21H30O4 346.46
Tetrabenazine D6 1392826-25-3 C19H21D6NO3 323.46
Radafaxine (hydrochloride) 106083-71-0 C13H19Cl2NO2 292.2
Vanilpyruvic acid 1081-71-6 C10H10O5 210.1834
Tetrabenazine (Racemate) 718635-93-9 C19H27NO3 317.42
Lobelane 530-51-8 C22H29N 307.47
GZ-11610 2141973-99-9 C19H25NO 283.41
GZ-793A 1356447-90-9 C26H37NO4 427.58
Tetrabenazine 58-46-8 C19H27NO3 317.42
(+)-Tetrabenazine D6 1977511-05-9 C19H21D6NO3 323.46

Recommended Compounds in Same Indication

Name CAS No Formula MW
NBI-98854 171598-74-6 C19H29NO3 319.44
Elbasvir 1370468-36-2 C49H55N9O7 882.02
MK-0822 603139-12-4 C23H26F3N3O3S 481.53
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Route of Synthesis

12

References

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More Information

NBI-98782

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