Compound Identification
SMILES
COC1=CC2=C(SC=C2C(=O)N[C@@H]2C[C@@H]3C[C@H]([C@H]2C\C=C\CCCC(O)=O)C3(C)C)C=C1
InChIKey
InChIKey=WJLITEZYXMARTE-BYNIIVGDSA-N
Formula
C26H33NO4S
Mass
455.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
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 1-benzothiophenes Thiophene carboxamides Medium-chain fatty acids Anisoles Alkyl aryl ethers Heterocyclic fatty acids Unsaturated fatty acids Heteroaromatic compounds Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pinane monoterpenoid - Aromatic monoterpenoid - Benzothiophene - 1-benzothiophene - Phenol ether - Medium-chain fatty acid - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - Anisole - Alkyl aryl ether - Heterocyclic fatty acid - Fatty acyl - Fatty acid - Benzenoid - Unsaturated fatty acid - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen 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