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(+)-Bakkenolide A

(+)-Bakkenolide A structure

(+)-Bakkenolide A 

structure
  • CAS No:

    19906-72-0

  • Formula:

    C15H22O2

  • Chemical Name:

    (+)-Bakkenolide A

  • Synonyms:

    Spiro[furan-3(2H),2′-[2H]inden]-2-one,decahydro-3′a,4′-dimethyl-4-methylene-,(2′R,3′aR,4′S,7′aR)-;Spiro[furan-3(2H),2′-indan]-2-one,3′a,4,4′,5,5′,6′,7′,7′aβ-octahydro-3′aβ,4′β-dimethyl-4-methylene-,(2′R)-;Spiro[furan-3(2H),2′-[2H]inden]-2-one,decahydro-3′a,4′-dimethyl-4-methylene-,[2′R-(2′α,3′aα,4′α,7′aα)]-;(2′R,3′aR,4′S,7′aR)-Decahydro-3′a,4′-dimethyl-4-methylenespiro[furan-3(2H),2′-[2H]inden]-2-one;Bakkenolide A;Fukinanolide;Bakkenolid A;Fukinanolid;(+)-Bakkenolide A;NSC 292655;19903-64-1

Description

Bakkenolide A is a natural product extracted from Petasites tricholobus. Bakkenolide A inhibits leukemia by regulation of HDAC3 and PI3K/Akt-related signaling pathways[1].


Bakkenolide A is a sesquiterpenoid.

(+)-Bakkenolide A Basic Attributes

234.337

234.33

T86ZPP5FMQ

DTXSID20173684

Characteristics

26.3

3.67

1.06

80.5-80.6 °C

360.7±31.0 °C at 760 mmHg

150.7±22.2 °C

1.518

2.18E-05mmHg at 25°C

Drug Information

bakkenolide A

Computed Properties

Molecular Weight:234.33
XLogP3:3.5
Hydrogen Bond Acceptor Count:2
Exact Mass:234.161979940
Monoisotopic Mass:234.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Complexity:386
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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