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β-Cedrene

CAT: 0013-GTR19233336Size: 20 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19233336Size:20 mg
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Description
(+) -β-Cedrene is a sesquiterpene with reported antibacterial, anti-inflammatory, and antifungal properties. It serves as a potent competitive inhibitor of human CYP2B6 (K i = 1.6 μM), making it a valuable tool for cytochrome P450 enzyme research in both in vitro and in vivo pharmacological studies.
CAS Number
546-28-1
Field of Research
Infectious Disease & Virology
Smiles
C[C@H]1[C@@]23[C@] (C (C) (C) [C@@] (C2) (C (=C) CC3) [H]) (CC1) [H]
Molecular Formula
C15H24
Molecular Weight
204.35
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(+)-beta-Cedrene

(+)-beta-cedrene is a cedrane sesquiterpenoid.

CAS Number546-28-1
PubChem CID11106485
IUPAC Name(1S,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.3.1.01,5]undecane
Molecular FormulaC15H24
Molecular Weight204.35
XLogP4.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity312
SMILES
C[C@@H]1CC[C@@H]2[C@]13CCC(=C)[C@H](C3)C2(C)C
InChI
InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12+,13+,15+/m1/s1
InChIKey
DYLPEFGBWGEFBB-OSFYFWSMSA-N
Chemical Structure
2D Structure
2D structure of (+)-beta-Cedrene
CAS: 546-28-1
CID: 11106485
Formula: C15H24
MW: 204.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight204.35
XLogP34.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass204.187800766
Monoisotopic Mass204.187800766
Topological Polar Surface Area0 Ų
Heavy Atom Count15
Formal Charge0
Complexity312
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19181887-01Cedrelone
GTR19181885Cedrin

Alternative Products

CatalogName
T30784-01Cedrene
JH335954(+) -β-Cedrene
sc-233763(-) -α-Cedrene
C05915-01(-) -a-Cedrene
HY-135190-01(-) -Cedrene
RG-E141252-01β-Cedrene
RG-E141251-01α-Cedrene
TRC-C364863-1G(-)-alpha-Cedrene (contains (+)-beta-cedrene)
TRC-C364868-100MG(+)-beta-Cedrene (major, contains (-)-cedrene)
TRC-C364863-25G(-)-a-Cedrene (major, contains (+)-b-cedrene)

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