Compound Identification
SMILES
CO[C@H]1[C@@H](C[C@@H]2C[NH+]3CCC4=C(NC5=C4C=CC(OC)=C5)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OS(=O)(=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=AWSOQGFEQNOXNW-GXTCVXTHSA-O
Formula
C29H34BrN2O7S
Mass
634.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Yohimbine alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Yohimbine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Yohimbine alkaloids
Alternative Parents
Corynanthean-type alkaloids Beta carbolines Delta amino acids and derivatives Benzenesulfonate esters 3-alkylindoles Benzenesulfonyl compounds Arylsulfonic acids and derivatives Anisoles Bromobenzenes Aralkylamines Alkyl aryl ethers Aryl bromides Organosulfonic acid esters Piperidines Heteroaromatic compounds Pyrroles Quaternary ammonium salts Methyl esters Sulfonyls Trialkylamines Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organobromides Organic oxides Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Yohimbine - Corynanthean skeleton - Yohimbine alkaloid - Beta-carboline - Delta amino acid or derivatives - Pyridoindole - Benzenesulfonate ester - Benzenesulfonate - 3-alkylindole - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Indole - Indole or derivatives - Anisole - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aralkylamine - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Organosulfonic acid ester - Piperidine - Methyl ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Quaternary ammonium salt - Pyrrole - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid ester - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Organohalogen compound - Amine - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as yohimbine alkaloids. These are alkaloids containing the pentacyclic yohimban skeleton. The Yohimbinoid alkaloids contain a carbocyclic ring E arising through C-17 to C-18 bond formation in a corynantheine precursor.
External Descriptors
Not available