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ChemicalBook--->CAS DataBase List--->57710-57-3

57710-57-3

57710-57-3 Structure

57710-57-3 Structure
IdentificationBack Directory
[Name]

heptelidic acid
[CAS]

57710-57-3
[Synonyms]

Avocettin
Koningic acid
heptelidic acid
(5aS,9S)-1,5aβ,6,7,8,9aα-Hexahydro-6β-isopropyl-1-oxospiro[2-benzoxepine-9(3H),2'-oxirane]-4-carboxylic acid
(5aS,9S)-1,5a,6,7,8,9aα-Hexahydro-6β-(1-methylethyl)-1-oxospiro[2-benzoxepine-9(3H),2'-oxirane]-4-carboxylic acid
Spiro[2-benzoxepin-9(3H),2'-oxirane]-4-carboxylic acid, 1,5a,6,7,8,9a-hexahydro-6-(1-methylethyl)-1-oxo-, (2'S,5aS,6R,9aS)-
[Molecular Formula]

C15H20O5
[MOL File]

57710-57-3.mol
[Molecular Weight]

280.32
Chemical PropertiesBack Directory
[Boiling point ]

501.1±50.0 °C(Predicted)
[density ]

1.27±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml
[form ]

A solid
[pka]

3.68±0.40(Predicted)
[color ]

Colorless to off-white
[LogP]

2.034 (est)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332
[Precautionary statements ]

P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P321-P330-P362+P364-P501
Hazard InformationBack Directory
[Uses]

Heptalidic acid is a?sesquiterpene lactone and found to inhibit etoposide-induced apoptosis in human leukemia U937 cells. In addition, it also?inhibit mammalian DNA polymerases and terminal deoxynucleotidyl transferase.
[in vivo]

Heptelidic acid (Koningic acid; KA) is bioavailable and induces dynamic changes to glycolysis in vivo[3].

Animal Model:6-week old female Foxn1nu mice bearing BT-474 tumor[3]
Dosage:1, 2.5, 5, and 10 mg/kg
Administration:Daily intraperitoneal (IP) injections, 24 hours
Result:1 mg/kg was determined to be the maximum tolerated dose (MTD) based upon behavioral monitoring and adverse events at higher doses (hemolysis, hematuria, and anemia).
[IC 50]

Caspase-3
[storage]

Store at -20°C
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