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Home > Encyclopedia > 2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one

2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one

2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one structure

2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one 

structure
  • CAS No:

    85233-29-0

  • Formula:

    C7H6O4

  • Chemical Name:

    2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one

  • Synonyms:

    3,7-dihydroxytropolone;BMY 28438;BMY-28438;3,7-Dihydroxytropolone;Bmy-28438;85233-29-0;2,3,7-trihydroxycyclohepta-2,4,6-trien-1-one;CHEMBL135189;SP15;2,4,6-Cycloheptatrien-1-one, 2,3,7-trihydroxy-;2,3,7-Trihydroxy-2,4,6-cycloheptatrien-1-one;188803-31-8;2,4,6-Cycloheptatrien-1-one, 2,3,4-trihydroxy-;Bmy 28438;2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one;SCHEMBL344192;CHEBI:156362;DTXSID701005715;BU-3129T;BDBM50498343;AKOS006273704;2,3,4-trihydroxy-1-cyclohepta-2,4,6-trienone;A843807;2,3,4-tris(oxidanyl)cyclohepta-2,4,6-trien-1-one

Description

3,7-dihydroxytropolone is a cyclic ketone that is tropolone in which the hydrogens at positions 3 and 7 are susbstituted by hydroxy groups. It is isolated from the soil bacterium Streptomyces tropolofaciens strain K611-97. It has a role as an antineoplastic agent and a bacterial metabolite. It is a cyclic ketone, a triol, an alpha-hydroxy ketone and an enol. It derives from a tropolone.

2,3,4-trihydroxycyclohepta-2,4,6-trien-1-one Basic Attributes

154.12 g/mol

154.02660867 g/mol

Characteristics

77.8 Ų

Drug Information

3,7-dihydroxytropolone

Computed Properties

Molecular Weight:154.12
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Exact Mass:154.02660867
Monoisotopic Mass:154.02660867
Topological Polar Surface Area:77.8
Heavy Atom Count:11
Complexity:283
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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