UCSF

ZINC14588455

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2008 11 No

Popular Name: 2-Methyl-5-(prop-1-en-2-yl)cyclohex-2-enone 2-Methyl-5-(prop-1-en-2-yl)cyclo…

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CAS Numbers: 2244-16-8 , 6485-40-1 , 6485-40-1, 99-49-0 , 732200-46-3 , 99-49-0 , [6485-40-1] , [99-49-0]

Other Names:

(-)-(4R)-carvone; (-)-(R)-carvone; (-)-Carvone; (-)-p-mentha-6,8-dien-2-one; (4R)-Carvone; (5R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; (R)-(-)-carvone; (R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; (R)-5-isopropenyl-2-methylcyclohex-2-en-

(-)-(4R)-carvone; (-)-(R)-carvone; (-)-p-mentha-6,8-dien-2-one; (5R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; (R)-(-)-carvone; (R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; (R)-5-isopropenyl-2-methylcyclohex-2-en-1-one; (R)-carvone; l-1-met

(-)-(R)-carvone; (-)-carvone; (-)-p-mentha-6,8-dien-2-one; (4R)-carvone; 6485-40-1; CPD-1089; levo-carvone

(-)-(R)-carvone;(-)-carvone;(-)-p-Mentha-6,8-dien-2-one;(4R)-(-)-Carvone;(R)-(-)-p-Mentha-6,8-dien-2-one;(R)-carvone;2-Methyl-5-(1-methylethenyl)-(R)-2-Cyclohexen-1-one;L(-)-Carvone;Levo-carvone

(-)-Carvone

(-)-Carvone-[6485-40-1]

(-)-Carvone; (4R)-Carvone; (R)-5-Isopropenyl-2-methyl-2-cyclohexenone; 2-cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-; 5-isopropenyl-2-methylcyclohex-2-en-1-one; Carvol; bmse000500; p-Mentha-6,8-dien-2-one

(-)-Carvone; (4R)-Carvone; 6485-40-1; C01767

(-)-Carvone; (R)-2-Methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; (R)-Carvone; 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (5R)-; 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (R)-; 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (theta)-

(-)-CARVONE; [6485-40-1]

(R)-(-)-5-Isopropenyl-2-methyl-2-cyclohexenone

(R)-(-)-Carvone

(R)-(-)-Carvone, 98%

(R)-(-)-p-Mentha-6,8-dien-2-one

(R)-2-Methyl-5-(prop-1-en-2-yl)cyclohex-2-enone

(R)-Carvone

(s)-carvone

1,5-Cyclohexadien-1-ol, 6-methyl-3-(1-methylethenyl)- (9CI)

1-Carvone; 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-; 2-Methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; 2-Methyl-5-isopropenyl-2-cyclohexenone; 6,8(9)-p-Menthadien-2-one; 6,8-p-Menthadien-2-on; AI3-08877; BRN 1364206; C10H14O; CARVONE; Carvol; Carv

1-carvone; 2-methyl-5-(1-methyl-1-ethenyl)-2-cyclohexen-1-one; 2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one; 2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enone; 2-methyl-5-isopropenyl-2-cyclohexenone; 5-isopropenyl-2-methylcyclohex-2-en-1-one; Carvon; Karvon

2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one

2-Methyl-5-isopropenyl-2-cyclohexen-1-one

Carvone

CCRIS 7499; Curled mint oil; EPA Pesticide Code 128800; FEMA No. 3032; HSDB 1919; LS-145724; Mentha spicata oil; Mint oil; Oil of crispmint; Oil of curled mint; Oil of spearmint; Oils, mentha spicata; Oils, spearmint; SPEARMINT, OIL (MENTHA SPICATA L.); S

CHEBI:10775; CHEBI:18480; CHEBI:86

D-Carvone;2-Methyl-5-(1-methylethenyl)-2-cyclohexene-1-one

D-Cavone

L(-)-Carvone

L(-)-Carvone, 99%

L-Carvone

MFCD00001578

MFCD00062996

p-mentha-1(6),8-dien-2-one

Download: MOL2 SDF SMILES Flexibase

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.51 6.14 -5.95 0 1 0 17 150.221 1 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 227 - 230 Acros Organics
Boiling_Point 228-230? Alfa-Aesar
Boiling_Point 228-230° Alfa-Aesar
Purity 95% Fluorochem
UniProt Database Links DBR2_ARTAN; DBR_TOBAC; LIHY_GEOSE; LIMC_RHOER; MLHB_RHOER; OLF49_MOUSE; OLF50_MOUSE; OR24A_DROME; OR67B_DROME ChEBI
Patent Database Links EP0971025; EP0971027; EP1067116; EP1067174; EP1552814; EP1705171; EP1857436; EP1952801; US2007184000; US2007184133; US2007207220; US2007224261; US2007231278; US2008274064; WO2007110790 ChEBI
H phrase H302: Harmful if swallowed Acros Organics
Target Insulin receptor(P06213)&RAC-alpha serine/threonine-protein kinase(P31749) Herbal Ingredients Targets
UniProt Database Links LIHY_GEOSE; LIMC_RHOER; OLF50_MOUSE ChEBI
P phrase P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell Acros Organics
R phrase R22: Harmful if swallowed. Acros Organics
Target Solute carrier family 2, facilitated glucose transporter member 4(P14672)&Dolichyl-phosphate beta-glucosyltransferase(Q9Y673) Herbal Ingredients Targets
Patent Database Links US2005244561 ChEBI
Hazard XN: Harmful Acros Organics

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