Compound Identification
SMILES
CCC1=NN2C(S1)=NC(=O)C(=CC1=CC(OC)=C(OCCOC3=C(C=CC(C)=C3)C(C)C)C(Cl)=C1)C2=N
InChIKey
InChIKey=OSPGXWXVZWBCSV-UHFFFAOYSA-N
Formula
C27H29ClN4O4S
Mass
541.06
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
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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 Anisoles Methoxybenzenes Toluenes Pyrimidones Alkyl aryl ethers Chlorobenzenes Imidolactams Hydropyrimidines Aryl chlorides Thiadiazolines N-acylimines Propargyl-type 1,3-dipolar organic compounds Amidines Azacyclic compounds Carboxylic acids and derivatives Hydrocarbon derivatives Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bicyclic monoterpenoid - P-cymene - Aromatic monoterpenoid - Cumene - Phenylpropane - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyrimidone - Toluene - Imidolactam - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Pyrimidine - Thiadiazoline - N-acylimine - Organoheterocyclic compound - Ether - Amidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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