Compound Identification
SMILES
COC1=C(O)C=C2CCN[C@@]3(CS[C@@H]4C5C6NC(CC7=CC(C)=C(OC)C(O)=C67)[C@H](C#N)N5C(COC3=O)C3=C4C(OC(C)=O)=C(C)C4=C3OCO4)C2=C1
InChIKey
InChIKey=OSIBSOLQCODQPC-ZNROEQIVSA-N
Formula
C39H40N4O10S
Mass
756.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzazocines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzazocines
Intermediate Tree Nodes
Not available
Direct Parent
Benzazocines
Alternative Parents
Tetrahydroisoquinolines Alpha amino acids and derivatives Benzodioxoles Anisoles 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers N-alkylpiperazines Aralkylamines Dicarboxylic acids and derivatives Trialkylamines Alpha-aminonitriles Lactones Carboxylic acid esters Azacyclic compounds Acetals Oxacyclic compounds Dialkylthioethers Dialkylamines Hydrocarbon derivatives Organic oxides Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazocine - Alpha-amino acid or derivatives - Tetrahydroisoquinoline - Benzodioxole - Anisole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Dicarboxylic acid or derivatives - Piperazine - Amino acid or derivatives - Alpha-aminonitrile - Tertiary aliphatic amine - Carboxylic acid ester - Lactone - Tertiary amine - Azacycle - Oxacycle - Organoheterocyclic compound - Dialkylthioether - Carboxylic acid derivative - Thioether - Secondary aliphatic amine - Acetal - Ether - Carbonitrile - Secondary amine - Nitrile - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Amine - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazocines. These are organic compounds containing the benzazocine ring system, which consists of a benzene ring bound to an azocine ring.
External Descriptors
Not available