ChemicalBook >> CAS DataBase List >>Octanoic acid, 6,8-bis[(phenylMethyl)thio]-

Octanoic acid, 6,8-bis[(phenylMethyl)thio]-

CAS No.
95809-78-2
Chemical Name:
Octanoic acid, 6,8-bis[(phenylMethyl)thio]-
Synonyms
CPI-613;Devimistat;CPI-613, >98%;CPI 613;CPI613;CPI-613(Devimistat);Devimistat (CPI-613);CPI-613;CPI 613;CPI613;Devimistat, 10 mM in DMSO;6,8-Bis(benzylthio)octanoic acid;alpha-lipoic acid analogue CPI-613
CBNumber:
CB52554078
Molecular Formula:
C22H28O2S2
Molecular Weight:
388.59
MDL Number:
MFCD22420826
MOL File:
95809-78-2.mol
MSDS File:
SDS
Last updated:2025-01-27 09:38:02

Octanoic acid, 6,8-bis[(phenylMethyl)thio]- Properties

Melting point 63-65℃
Boiling point 553.0±50.0 °C(Predicted)
Density 1.149
storage temp. 2-8°C
solubility DMSO: soluble15mg/mL (clear solution)
form powder
pka 4.75±0.10(Predicted)
color white to beige
Stability Stable for 2 years from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 3 months.
FDA UNII E76113IR49
NCI Drug Dictionary devimistat
UNSPSC Code 12352106
NACRES NA.77

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS09
Signal word  Warning
Hazard statements  H410
Precautionary statements  P273-P501
Hazard Codes  N
Risk Statements  50/53
Safety Statements  60-61
RIDADR  UN 3077 9 / PGIII
WGK Germany  3
HS Code  2930.90.2900
NFPA 704
0
2 0

Octanoic acid, 6,8-bis[(phenylMethyl)thio]- price More Price(37)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich SML0404 6,8-Bis(benzylthio)-octanoic acid ≥98% (HPLC) 95809-78-2 5mg $64.8 2024-03-01 Buy
Sigma-Aldrich SML0404 6,8-Bis(benzylthio)-octanoic acid ≥98% (HPLC) 95809-78-2 25mg $429 2024-03-01 Buy
TCI Chemical B5368 6,8-Bis(benzylthio)octanoic Acid 95809-78-2 5MG $112 2024-03-01 Buy
TCI Chemical B5368 6,8-Bis(benzylthio)octanoic Acid 95809-78-2 25MG $388 2024-03-01 Buy
Cayman Chemical 16981 CPI-613 ≥98% 95809-78-2 5mg $39 2024-03-01 Buy
Product number Packaging Price Buy
SML0404 5mg $64.8 Buy
SML0404 25mg $429 Buy
B5368 5MG $112 Buy
B5368 25MG $388 Buy
16981 5mg $39 Buy

Octanoic acid, 6,8-bis[(phenylMethyl)thio]- Chemical Properties,Uses,Production

Description

CPI-613 (95809-78-2) is a lipoic acid analog which potently disrupts mitochondrial metabolism with selectivity for tumor cells in vitro and shows strong antitumor activity in vivo.1?? Inhibits alpha-ketoglutarate dehydrogenase (KGDH) by a redox mechanisms selectively in tumor cells.2 Inhibits pyruvate dehydrogenase (PDH) as a mechanistically distinct, non-redox, effect.1,2 A novel anticancer agent with a mitochondria-targeted mode of action with non-genotoxic properties.3. Has been used (along with PS48) to induce a Warburg-like metabolic state in fibroblasts.4 Combination treatment of CPI-613 and chloroquine inhibits the progression of clear cell sarcoma in a mouse model.5

Uses

CPI 613 is a class of non-redox-active lipoate derivative that disrupts cancer cell mitochondrial metabolism and are potent anticancer agents in vivo.

Uses

6,8-Bis(benzylthio)-octanoic acid has been used as pyruvate dehydrogenase (PDH) inhibitor:

  • to study its effects on neurite outgrowth in primary mouse dorsal root ganglia cells
  • to induce α-smooth muscle actin (αSMA) and pro-collagen I expression and to assess PDH enzyme activity in whole-cell lysates
  • to validate basal respiration in tissue respirometry

Biochem/physiol Actions

6,8-Bis(benzylthio)-octanoic acid (CPI-613) is a lipoate analog. It acts as a mitochondrial disrupter by blocking the mitochondrial enzymes pyruvate dehydrogenase and α-ketoglutarate dehydrogenase.

storage

Store at +4°C

References

1) Zachar et al. (2011), Non-redox-active Lipoate Derivates Disrupt Cancer Cell Mitochondrial Metabolism and Are Potent Anticancer Agents in Vivo; J. Mol. Med. (Berl), 89 1137 2) Stuart et al. (2014), A Strategically designed Small Molecule Attacks Alpha-ketoglutarate Dehydrogenase in Tumor Cells Through a Redox Process; Cancer Metab., 2 4 3) Dorsam and Fahrer (2016), The Disulfide Compound α-lipoic Acid and Its Derivatives: A Novel Class of Anticancer Agents Targeting Mitochondria; Cancer Lett., 371(1) 12 4) Mordhorst et al. (2018), Pharmacologic Reprogramming Designed to Induce a Warburg Effect in Porcine Fetal Fibroblasts Alters Gene Expression and Quantities of Metabolites From Conditioned Media Without Increased Cell Proliferation; Cell Reprogram., 20 38 5) Egawa et al. (2018), Therapeutic Potential of CPI-613 for Targeting Tumorous Mitochondrial Energy Metabolism and Inhibiting Autophagy in Clear Cell Sarcoma; PLoS One, 13(6) e0198940

Octanoic acid, 6,8-bis[(phenylMethyl)thio]- Preparation Products And Raw materials

Raw materials

Preparation Products

Global( 163)Suppliers
Supplier Tel Email Country ProdList Advantage
Hangzhou FandaChem Co.,Ltd.
008657128800458; +8615858145714 FandaChem@Gmail.com China 3237 55
ATK CHEMICAL COMPANY LIMITED
+undefined-21-51877795 ivan@atkchemical.com China 33024 60
Hubei xin bonus chemical co. LTD
86-13657291602 linda@hubeijusheng.com CHINA 22963 58
CONIER CHEM AND PHARMA LIMITED
+8618523575427 sales@conier.com China 49732 58
Shaanxi Dideu Medichem Co. Ltd
+86-29-87569262 +86-15003564040 1087@dideu.com China 3285 58
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd
+8613580539051 joe@yuhengpharm.com CHINA 21142 58
TargetMol Chemicals Inc.
+1-781-999-5354 +1-00000000000 marketing@targetmol.com United States 32202 58
Career Henan Chemica Co
+86-0371-86658258 +8613203830695 laboratory@coreychem.com China 30230 58
Dideu Industries Group Limited
+86-29-89586680 +86-15129568250 1026@dideu.com China 22854 58
Zhejiang J&C Biological Technology Co.,Limited
+1-2135480471 +1-2135480471 sales@sarms4muscle.com China 10473 58

View Lastest Price from Octanoic acid, 6,8-bis[(phenylMethyl)thio]- manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
Devimistat pictures 2025-04-27 Devimistat
95809-78-2
US $53.00-108.00 / mg 99.24% 10g TargetMol Chemicals Inc.
CPI 613  pictures 2025-01-03 CPI 613
95809-78-2
US $0.00-0.00 / KG 5mg 99% HPLC 2000tons Shaanxi Dideu Medichem Co. Ltd
  • Devimistat pictures
  • Devimistat
    95809-78-2
  • US $53.00-108.00 / mg
  • 99.24%
  • TargetMol Chemicals Inc.
  • CPI 613  pictures
  • CPI 613
    95809-78-2
  • US $0.00-0.00 / KG
  • 99% HPLC
  • Shaanxi Dideu Medichem Co. Ltd

Octanoic acid, 6,8-bis[(phenylMethyl)thio]- Spectrum

alpha-lipoic acid analogue CPI-613 CPI-613 CPI-613; OCTANOIC ACID, 6,8-BIS[(PHENYLMETHYL)THIO]- Octanoic acid, 6,8-bis[(phenylMethyl)thio]- 6,8-Bis(benzylthio)octanoic acid 6,8-Bis[(phenylmethyl)thio]octanoic acid 6,8-Bis[(phenylmethyl)thio]octanoic acid CPI-613 6,8-Bis(benzylsulfanyl)octanoic acid CPI 613;CPI613 (+/-)6,8-bis-thiobenzyl octanoic acid CPI-613(Devimistat) CPI-613;CPI 613;CPI613 CPI-613, >98% Devimistat CPI613; CPI-613; CPI 613; DEVIMISTAT Octanoic acid, 6,8-bis[(phenylMethyl)thio]- USP/EP/BP Devimistat (CPI-613) 6,8-Bis(benzylsulfanyl)octanoicaci Devimistat, 10 mM in DMSO 95809-78-2 Inhibitor Inhibitors