CAS 11076-19-0|Bongkrekic acid

Introduction:Basic information about CAS 11076-19-0|Bongkrekic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameBongkrekic acid
CAS Number11076-19-0Molecular Weight486.59700
Density1.114g/cm3Boiling Point715.1ºC at 760mmHg
Molecular FormulaC28H38O7Melting Point50-60°
MSDSChineseUSAFlash Point231ºC

Names

Namebongkrekic acid
SynonymMore Synonyms

Bongkrekic acid BiologicalActivity

DescriptionBongkrekic acid is a mitochondrial toxin secreted by the bacteria Pseudomonas cocovenenans[1]. Bongkrekic acid specific ligand for mitochondrial adenine nucleotide translocase (ANT) rather than the electron transport chain. Bongkrekic acid has to cross the mitochondrial inner membrane to produce its inhibitory effect on ADP/ATP transport[2].
Related CatalogResearch Areas >>CancerResearch Areas >>InfectionSignaling Pathways >>Membrane Transporter/Ion Channel >>ATP Synthase
In VitroBongkrekic acid (0-50 μM; 48 hours) stimulated formazan formation in MDA-MB-231, MCF-7 and LTED cells with EC50 of 34.14 μM, >50 μM and 2.58 μM, respectively. Bongkrekic acid (0.1-25 μM; 48 hours) decreases the living cell numbers in LTED cells and parent MCF-7 cells in a dose-dependent manner[1].
References

[1]. Mehruba Anwar, et al. Bongkrekic Acid-a Review of a Lesser-Known Mitochondrial Toxin. J Med Toxicol. 2017 Jun;13(2):173-179.

[2]. C Dahout-Gonzalez, et al. Molecular, functional, and pathological aspects of the mitochondrial ADP/ATP carrier. Physiology (Bethesda)

[3]. Shuso Takeda, et al. Bongkrekic Acid as a Warburg Effect Modulator in Long-term Estradiol-deprived MCF-7 Breast Cancer Cells. Anticancer Res

Chemical & Physical Properties

Density1.114g/cm3
Boiling Point715.1ºC at 760mmHg
Melting Point50-60°
Molecular FormulaC28H38O7
Molecular Weight486.59700
Flash Point231ºC
Exact Mass486.26200
PSA121.13000
LogP5.88560
Appearance of CharactersLyophilized solid
Index of Refraction1.545
InChIKeySHCXABJSXUACKU-WUTQZGRKSA-N
SMILESCOC(CC=CC=CCCC=CCC(C)C=CC(=CC(=O)O)CC(=O)O)C(C)=CC=C(C)C(=O)O
Storage condition-20°C
Water SolubilitySoluble in DMSO (up to 100 mg/ml) or in Water (up to 1 mg/ml).

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
JR1230000
CHEMICAL NAME :
2,4,8,10,14,18,20-Docosaheptaenedioic acid, 20-(carboxymethyl)-6-methoxy-2,5,17-trimethyl-, (R-(R*,S*(E,Z,Z,E,E,Z,E)))-
CAS REGISTRY NUMBER :
11076-19-0
LAST UPDATED :
199707
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C28-H38-O7
MOLECULAR WEIGHT :
486.66
WISWESSER LINE NOTATION :
QVY1&U2UY1&YO1&2U2U4U2Y1&1U1Y1VQU1VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1410 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TETRAB Tetrahedron. (Pergamon Press Inc., Maxwell House, Fairview Park, Elm sford, NY 10523) V.1- 1957- Volume(issue)/page/year: 26,5993,1970

Safety Information

Personal Protective EquipmentEyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
RIDADRNONH for all modes of transport

Articles7

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Synonyms

Bongkrekic Acid, Triammonium Salt
BONGKREKIC ACID
Bongkrekic acid solution
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