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(S) -ar-Turmerone

CAT: 0024-sc-491935Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-491935Size:10 mg
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CAS Number
532-65-0

Chemical Information

(+)-Turmerone

(+)-(S)-ar-turmerone is a sesquiterpenoid that is 2-methylhept-2-en-4-one substituted by a 4-methylphenyl group at position 6. It has been isolated from Peltophorum dasyrachis. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor and a plant metabolite. It is a sesquiterpenoid and an enone.

CAS Number532-65-0
PubChem CID160512
IUPAC Name(6S)-2-methyl-6-(4-methylphenyl)hept-2-en-4-one
Molecular FormulaC15H20O
Molecular Weight216.32
XLogP4
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity253
SMILES
CC1=CC=C(C=C1)[C@@H](C)CC(=O)C=C(C)C
InChI
InChI=1S/C15H20O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5-9,13H,10H2,1-4H3/t13-/m0/s1
InChIKey
NAAJVHHFAXWBOK-ZDUSSCGKSA-N
Chemical Structure
2D Structure
2D structure of (+)-Turmerone
CAS: 532-65-0
CID: 160512
Formula: C15H20O
MW: 216.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight216.32
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass216.151415257
Monoisotopic Mass216.151415257
Topological Polar Surface Area17.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity253
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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