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γ-Cadinene

CAT: 0931-T80684-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T80684-01Size:5 mg
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CAS Number
39029-41-9
Bioactivity
γ-Cadinene is a naturally occurring compound identified in Tabernaemontana catharinensis [1].
Smiles
C(C)(C)[C@@H]1[C@@]2([C@@](C(=C)CC1)(CCC(C)=C2)[H])[H]
Molecular Formula
C15H24
Molecular Weight
204.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

gamma-Cadinene

(+)-gamma-cadinene is a member of the cadinene family of sesquiterpenes in which the isopropyl group is cis to the hydrogen at the adjacent bridgehead carbon (the 1S,4aR,8aR enantiomer). It is a member of octahydronaphthalenes, a gamma-cadinene and a cadinene. It is an enantiomer of a (-)-gamma-cadinene.

CAS Number39029-41-9
PubChem CID6432404
IUPAC Name(1S,4aR,8aR)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Molecular FormulaC15H24
Molecular Weight204.35
XLogP4.3
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity282
SMILES
CC1=C[C@@H]2[C@@H](CC1)C(=C)CC[C@H]2C(C)C
InChI
InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13-15H,4-8H2,1-3H3/t13-,14-,15-/m0/s1
InChIKey
WRHGORWNJGOVQY-KKUMJFAQSA-N
Chemical Structure
2D Structure
2D structure of gamma-Cadinene
CAS: 39029-41-9
CID: 6432404
Formula: C15H24
MW: 204.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight204.35
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass204.187800766
Monoisotopic Mass204.187800766
Topological Polar Surface Area0 Ų
Heavy Atom Count15
Formal Charge0
Complexity282
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes