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(+)-neoisopulegol


Name(s) (+)-neoisopulegol
Scientific name(s) neoisopulegol; isopulegol; unii-b1a5v2613y; b1a5v2613y; neo-isopulegol; 29141-10-4; neo-iso-pulegol
Formula C10H18O
Molecular mass 154.2493
IUPAC name (1S,2S,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol; (1s,2s,5r)-5-methyl-2-(prop-1-en-2-yl)cyclohexan-1-ol
INCHI InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10+/m1/s1
SMILE C[C@@H]1CC[C@H]([C@@H](O)C1)C(C)=C
CAS ID 89-79-2; 20549-46-6
PubChem ID 6553885
DrugBank ID Not available
CHEBI ID Not available
Description (+)-neoisopulegol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes (+)-neoisopulegol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). (+)-neoisopulegol can be found in ginger, peppermint, and spearmint, which makes (+)-neoisopulegol a potential biomarker for the consumption of these food products.