Compound Identification
SMILES
COC1=CC=CC(CC(=O)N2CCC3(CCN(C3)C(=O)CC3C(C[N+]([O-])=O)C(C)CC3=O)CC2)=C1
InChIKey
InChIKey=OZNRWSGEOHVSJO-UHFFFAOYSA-N
Formula
C26H35N3O6
Mass
485.581
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Iridoids and derivatives
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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
Iridoids and derivatives
Alternative Parents
Phenylacetamides Aromatic monoterpenoids Azaspirodecane derivatives N-acylpiperidines Phenoxy compounds Anisoles Methoxybenzenes N-acylpyrrolidines Alkyl aryl ethers Tertiary carboxylic acid amides C-nitro compounds Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organonitrogen compounds Organic salts Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aromatic monoterpenoid - Azaspirodecane - 11-noriridane monoterpenoid - Phenylacetamide - N-acyl-piperidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - N-acylpyrrolidine - Alkyl aryl ether - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyrrolidine - Tertiary carboxylic acid amide - Cyclic ketone - C-nitro compound - Ketone - Carboxamide group - Organic nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as iridoids and derivatives. These are monoterpenes containing a skeleton structurally characterized by the presence of a cylopentane fused to a pyran ( forming a 4,7-dimethylcyclopenta[c]pyran), or a derivative where the pentane moiety is open.
External Descriptors
Not available