Compound Identification
SMILES
COC(=O)C=C(C(=O)OC)C1=C(CC(C)(C)CC1=O)N1CCCC1
InChIKey
InChIKey=QEVMPNQWHLLUCC-UHFFFAOYSA-N
Formula
C18H25NO5
Mass
335.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Menthane monoterpenoids
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Subclass
Monoterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Menthane monoterpenoids
Alternative Parents
Monocyclic monoterpenoids Fatty acid esters Cyclohexenones Dicarboxylic acids and derivatives Vinylogous amides Pyrrolidines Methyl esters Enoate esters Trialkylamines Amino acids and derivatives Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
P-menthane monoterpenoid - Monocyclic monoterpenoid - Cyclohexenone - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Pyrrolidine - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Cyclic ketone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Enamine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as menthane monoterpenoids. These 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.
External Descriptors
Not available