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Verbenone

CAT: 0931-T5548-02Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T5548-02Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1196-01-6
Target
Others
Related Pathways
Others
Purity
0.9852
Bioactivity
(-) -Verbenone is a naturally occurring terpene found in the leaves of Suregada zanzibariensis Verdc.Verbenone has anti-aggregation pheromone effects and interrupts the attraction of bark beetles to its aggregation pheromone.
Smiles
CC1=CC(=O)[C@H]2C[C@@H]1C2(C)C
Molecular Formula
C10H14O
Molecular Weight
150.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Levoverbenone

(S)-(-)-verbenone is a 4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-one in which both chiral centres have S configuration. It has a role as an expectorant. It is an enantiomer of a (R)-(+)-verbenone.

CAS Number1196-01-6
PubChem CID92874
IUPAC Name(1S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-one
Molecular FormulaC10H14O
Molecular Weight150.22
XLogP1.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity248
SMILES
CC1=CC(=O)[C@H]2C[C@@H]1C2(C)C
InChI
InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m0/s1
InChIKey
DCSCXTJOXBUFGB-JGVFFNPUSA-N
Chemical Structure
2D Structure
2D structure of Levoverbenone
CAS: 1196-01-6
CID: 92874
Formula: C10H14O
MW: 150.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.22
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass150.104465066
Monoisotopic Mass150.104465066
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity248
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TRC-V128010-100MG(-)-Verbenone
BUP18895Verbenone
S5680-01(-) -Verbenone
FV01753-01(1S) - (-) - (-) -Verbenone
HY-N6661R-01Verbenone (Standard)
sc-506121(1S) - (−) -Verbenone
90028816(1S) - (‚àí) -Verbenone
sc-254025(1S) - (-) -Verbenone
468639-01(-) -Verbenone discontinued. See 291861

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