Compound Identification
SMILES
COC1=CC=CC(NC(=O)C23CCC(C)(\C(C2)=N/OC(=O)C2=CC=CC=C2Br)C3(C)C)=C1
InChIKey
InChIKey=VPBNNVQZIJLFLH-RRAHZORUSA-N
Formula
C25H27BrN2O4
Mass
499.405
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Bicyclic 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
Bicyclic monoterpenoids
Alternative Parents
2-halobenzoic acids and derivatives Aromatic monoterpenoids Methoxyanilines Anilides Phenoxy compounds N-arylamides Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers Bromobenzenes Aryl bromides Vinylogous halides Oxime esters Secondary carboxylic acid amides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Bicyclic monoterpenoid - Bornane monoterpenoid - Aromatic monoterpenoid - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Methoxyaniline - Anilide - Phenoxy compound - Benzoyl - Phenol ether - Anisole - Methoxybenzene - N-arylamide - Halobenzene - Bromobenzene - Alkyl aryl ether - Aryl bromide - Benzenoid - Monocyclic benzene moiety - Aryl halide - Vinylogous halide - Oximester - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
External Descriptors
Not available