Compound Identification
SMILES
COCCOC(=O)C1=C(C)N=C2SC(=CC3=CC=C(OCC4=CC=CC=C4C#N)C=C3)C(=O)N2C1C1=CC=C(C=C1)C(C)C
InChIKey
InChIKey=UWBLVADJQLAKSH-UHFFFAOYSA-N
Formula
C35H33N3O5S
Mass
607.73
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
Aromatic monoterpenoids Phenylpropanes Cumenes Phenoxy compounds Phenol ethers Benzonitriles Alkyl aryl ethers Thiazoles Heteroaromatic compounds Enoate esters Lactams Isothioureas Nitriles Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Bicyclic monoterpenoid - Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Benzonitrile - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Enoate ester - Thiazole - Heteroaromatic compound - Azole - Alpha,beta-unsaturated carboxylic ester - Lactam - Carboxylic acid ester - Isothiourea - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - 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