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Curdione

CAT: 0013-GTR19161323-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19161323-02Size:5 mg
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Description
Curdione inhibits CYP3A4 activity and the production of prostaglandin E2. Curdione inhibits proliferation of MCF-7 cells by inducing apoptosis. Curdione may be a candidate for anti-inflammatory and Y chemopreventive agents.
CAS Number
13657-68-6
Product Name Alternative
(+) -Curdione
Purity
>98% (HPLC)
Solubility
DMSO : ≥ 100 mg/mL. 423.10 mM
Smiles
C\1=C (/CC (=O) [C@H] (CC (=O) [C@H] (CC1) C) C (C) C) \C
Molecular Formula
C15H24O2
Molecular Weight
236.34
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

(3S,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione

Curdione is a germacrane sesquiterpenoid.

CAS Number13657-68-6
PubChem CID6441391
IUPAC Name(3S,6E,10S)-6,10-dimethyl-3-propan-2-ylcyclodec-6-ene-1,4-dione
Molecular FormulaC15H24O2
Molecular Weight236.35
XLogP2.7
Topological Polar Surface Area34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity326
SMILES
C[C@H]1CC/C=C(/CC(=O)[C@@H](CC1=O)C(C)C)\C
InChI
InChI=1S/C15H24O2/c1-10(2)13-9-14(16)12(4)7-5-6-11(3)8-15(13)17/h6,10,12-13H,5,7-9H2,1-4H3/b11-6+/t12-,13-/m0/s1
InChIKey
KDPFMRXIVDLQKX-NHFJXKHHSA-N
Chemical Structure
2D Structure
2D structure of (3S,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione
CAS: 13657-68-6
CID: 6441391
Formula: C15H24O2
MW: 236.35
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight236.35
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass236.177630004
Monoisotopic Mass236.177630004
Topological Polar Surface Area34.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity326
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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