(-)-Rotundone

cas: 18374-76-0 — see every product listed under this CAS number, including other names

(-)-Rotundone (CAS 18374-76-0) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULG180005
cas18374-76-0
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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Rotundone is a sesquiterpenoid.

Source: ChEBI

Identity
Molecular formulaC15H22O
Molecular weight218.33 g/mol
IUPAC name(3S,5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one
InChIKeyNUWMTBMCSQWPDG-SDDRHHMPSA-N
SMILESC[C@H]1CC[C@H](CC2=C1C(=O)C[C@@H]2C)C(=C)C

Computed by PubChem (NCBI)

Synonyms: Rotundone, Fema No. 4867, Guaia-1(5),11-dien-2-one, (-)-, (-)-Rotundone, (3S,5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one, 3,8-Dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one, (3S,5R,8S)-, Rotundone - 30%, Rotundone - 90%, NUWMTBMCSQWPDG-SDDRHHMPSA-N, (3s,5r,8s)-5-isopropenyl-3,8-dimethyl-3,4,5,6,7,8-hexahydro-1(2h)-azulenone
Isomers (same molecular formula)
1-phenylnonan-1-one C15H22O
4-(4-propylcyclohexyl)phenol C15H22O
[4-(4,4-dimethylcyclohexyl)phenyl]methanol C15H22O
2-methyl-1-(4-pentylphenyl)propan-1-one C15H22O
4-octylbenzaldehyde C15H22O
(4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one C15H22O
4-(4-propylcyclohexyl)phenol C15H22O
1-(4-tert-butylphenyl)-2-methylbutan-1-one C15H22O
(3E,7E)-3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,7-dien-1-one C15H22O
(2E,6Z)-2,6-dimethyl-10-methylidenedodeca-2,6,11-trienal C15H22O
2,5-ditert-butylbenzaldehyde C15H22O
2-[(1R,4R,4aS,8aR)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]prop-2-enal C15H22O

Also listed as

Rotundone, >95% (GC) TRC CAS 18374-76-0
Rotundone - 90% Biosynth CAS 18374-76-0
Rotundone - 30% Biosynth CAS 18374-76-0
(-)-Rotundone, Concentration: 100 µg/ml Solvent: Methanol HPC Standards CAS 18374-76-0