Compound Identification
SMILES
COP(=S)(OC)OC1=NC(Cl)=C(Cl)C=C1Cl.CC(C)=C[C@@H]1[C@@H](C(=O)OCC2=COC(CC3=CC=CC=C3)=C2)C1(C)C
InChIKey
InChIKey=HUXJZAYUHJRIEP-FDOHDBATSA-N
Formula
C29H33Cl3NO6PS
Mass
660.97
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 Aromatic 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
Aromatic monoterpenoids
Alternative Parents
Aryl thiophosphates Monocyclic monoterpenoids Thiophosphate triesters Polyhalopyridines 2-halopyridines Aryl chlorides Benzene and substituted derivatives Cyclopropanecarboxylic acids and derivatives Furans Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Aromatic monoterpenoid - Aryl thiophosphate - Monocyclic monoterpenoid - Thiophosphate triester - Polyhalopyridine - 2-halopyridine - Thiophosphoric acid ester - Aryl chloride - Pyridine - Cyclopropanecarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Organic thiophosphoric acid or derivatives - Aryl halide - Furan - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organonitrogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.
External Descriptors
Not available