NDI-010976 structure, CAS 1434635-54-7

NDI-010976

CAS Number1434635-54-7

SynonymsND-630; GS-0976; NDI-010976

Molecular FormulaC28H31O8N3S1

Molecular Weight569.64

Purity

Density1.4±0.1 g/cm3

Boiling Point779.0±70.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

Signal Word

Cat. No.: 2A-2189509 Purity:
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Quality Control of [ 1434635-54-7 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number1434635-54-7
Catalog No.2A-2189509
Chinese NameFirsocostat
SynonymsND-630; GS-0976; NDI-010976
Molecular FormulaC28H31O8N3S1
Molecular Weight569.64
Density1.4±0.1 g/cm3
Boiling Point779.0±70.0 °C at 760 mmHg
Storage Condition-20°C, sealed, dry
ApplicationFirsocostat (ND-630; GS-0976; NDI-010976) is an inhibitor of acetyl-CoA carboxylase (ACC), inhibiting human ACC1 and ACC2 with IC50 values ​​of 2.1 and 6.1 nM, respectively.
PubChem ID163522090
MDL NumberMFCD28963986
SMILESCOc1ccccc1C(Cn1c(=O)n(C(C)(C)C(=O)O)c(=O)c2c(C)c(-c3ncco3)sc21)OC1CCOCC1
InChIInChI=1S/C28H31N3O8S/c1-16-21-24(32)31(28(2,3)26(33)34)27(35)30(25(21)40-22(16)23-29-11-14-38-23)15-20(39-17-9-12-37-13-10-17)18-7-5-6-8-19(18)36-4/h5-8,11,14,17,20H,9-10,12-13,15H2,1-4H3,(H,33,34)/t20-/m0/s1
InChI KeyZZWWXIBKLBMSCS-FQEVSTJZSA-N
Transport InfoProduct Name: Firsocostat (GS-0976)
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