Compound Identification
SMILES
COC1=CC=C(C=C1)S(=O)(=O)N1CC2=C(C[C@@H]1C(=O)NO)C1=CC=CC=C1N2CC(=O)NCCSCCN1CCOCC1
InChIKey
InChIKey=IKMQUVGDRDSWNM-AREMUKBSSA-N
Formula
C29H37N5O7S2
Mass
631.76
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Pyridoindoles
- Level 5 Beta carbolines
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Subclass
Pyridoindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyridoindoles
Intermediate Tree Nodes
Not available
Direct Parent
Beta carbolines
Alternative Parents
Alpha amino acid amides 3-alkylindoles Benzenesulfonamides N-alkylindoles Benzenesulfonyl compounds Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Substituted pyrroles Organosulfonamides Morpholines Sulfonyls Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Hydroxamic acids Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Dialkyl ethers Dialkylthioethers Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-alkylindole - Benzenesulfonamide - 3-alkylindole - Benzenesulfonyl group - Indole - Phenoxy compound - Phenol ether - Anisole - Methoxybenzene - Alkyl aryl ether - Morpholine - Oxazinane - Substituted pyrrole - Organosulfonic acid amide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Hydroxamic acid - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Oxacycle - Azacycle - Dialkylthioether - Sulfenyl compound - Thioether - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta carbolines. These are compounds containing a 9H-pyrido[3,4-b]indole moiety.
External Descriptors
Not available