Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(CN2N=C(C(=O)NCC3CCC4CC3C4(C)C)C3=C2C2=C(C3)SC(Br)=C2)C=C1

InChIKey

InChIKey=VNZYBRYFFFEPNX-UHFFFAOYSA-N

Formula

C27H30BrN3OS

Mass

524.52

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aromatic monoterpenoid - Pinane monoterpenoid - 2-heteroaryl carboxamide - Pyrazole-5-carboxamide - 2,3,5-trisubstituted thiophene - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiophene - Pyrazole - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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

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