Alpha-Cyperone

CAT: 0127-BUP06824-04Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP06824-04Size:500 mg

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CAS Number

473-08-5

Synonyms

(+) -a-Cyperone, a-Cyperone

Purity

=98%

Smiles

CC(=C)[C@@H]1CC[C@@]2(C)CCC(=O)C(C)=C2C1

Chemical Information

(+)-alpha-Cyperone

alpha-Cyperone has been reported in Swertia japonica, Artemisia herba-alba, and other organisms with data available.

CAS Number	473-08-5
PubChem CID	6452086
IUPAC Name	(4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
Molecular Formula	C15H22O
Molecular Weight	218.33
XLogP	3.8
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	16
Formal Charge	0
Complexity	375

SMILES

CC1=C2C[C@@H](CC[C@]2(CCC1=O)C)C(=C)C

InChI

InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15+/m1/s1

InChIKey

KUFXJZXMWHNCEH-DOMZBBRYSA-N

Chemical Structure

2D Structure

CAS: 473-08-5

CID: 6452086

Formula: C15H22O

MW: 218.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	218.33
XLogP3	3.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	218.167065321
Monoisotopic Mass	218.167065321
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	375
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BIBR1034	Cyperine
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OR1077924	4-Nitro-alpha, alpha, alpha', alpha'-tetrabromo-o-xylene
OR1015475-01	Alpha, alpha-Dimethylphenethyl butyrate
OR1003593-01	Alpha-methyl-alpha-propylsuccinimide
OR1015474-01	Alpha- (Diethoxyphosphinyl) -alpha-Phenylacetophenone
OR1013423-01	Glycerol Alpha, Alpha-Diacetate
OR1012464-01	Bis[Rhodium (alpha, alpha, alpha', alpha'-Tetramethyl-1,3-Benzenedipropionic Acid) ]
DE2199	Benzyl-alpha, alpha-D2-amine
BUP16967	3-Isopropenyl-alpha, alpha-dimethylbenzyl