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7-Hydroxytropolone

CAT: 0013-GTR19257756-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19257756-02Size:50 mg
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Description
7-Hydroxytropolone (3-Hydroxytropolone) is an antibiotic that exhibits activity against Gram-positive and Gram-negative bacteria, as well as yeasts and fungi. It also functions as an inhibitor of 2''-O-adenylate transferase.
CAS Number
34777-04-3
Field of Research
Infectious Disease & Virology
Smiles
O=C1C=CC=CC (O) =C1O
Molecular Formula
C7H6O3
Molecular Weight
138.12
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7-Hydroxytropolone

7-hydroxytropolone is a cyclic ketone.

CAS Number34777-04-3
PubChem CID36917
IUPAC Name2,3-dihydroxycyclohepta-2,4,6-trien-1-one
Molecular FormulaC7H6O3
Molecular Weight138.12
XLogP0.8
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity246
SMILES
C1=CC(=C(C(=O)C=C1)O)O
InChI
InChI=1S/C7H6O3/c8-5-3-1-2-4-6(9)7(5)10/h1-4H,(H2,8,9,10)
InChIKey
ABNPYUDYGCGOTK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Hydroxytropolone
CAS: 34777-04-3
CID: 36917
Formula: C7H6O3
MW: 138.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight138.12
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass138.031694049
Monoisotopic Mass138.031694049
Topological Polar Surface Area57.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity246
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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