Compound Identification
SMILES
COC1=C(C)C=C2C[C@@H]3[C@H](O)N4[C@H]5COC(=O)C(=O)CS[C@@H]([C@H]4[C@H](N3C)C2=C1O)C1=C5C2=C(OCO2)C(C)=C1OC(C)=O
InChIKey
InChIKey=UTDHFANDDXEPGY-BYDPSFGYSA-N
Formula
C30H32N2O10S
Mass
612.65
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzazocines
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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 Benzodioxoles Anisoles N-methylpiperazines Aralkylamines Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Dicarboxylic acids and derivatives Trialkylamines Lactones Hemiaminals Cyclic ketones Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Dialkylthioethers Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazocine - Tetrahydroisoquinoline - Benzodioxole - Anisole - 1-hydroxy-4-unsubstituted benzenoid - Aralkylamine - N-alkylpiperazine - N-methylpiperazine - Alkyl aryl ether - Piperazine - Dicarboxylic acid or derivatives - 1,4-diazinane - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Lactone - Ketone - Hemiaminal - Carboxylic acid ester - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Thioether - Ether - Carboxylic acid derivative - Alkanolamine - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - 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