Compound Identification
SMILES
O=[99Tc+]=O.CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)C1=CC=C(C)C=C1)C(=O)OCCCCCC1CNCCNCCC(=O)[N-]CCNC1
InChIKey
InChIKey=YABXTLDUXXKITF-AUVBFITASA-M
Formula
C31H50N5O5Tc
Mass
671.677
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Tropane alkaloids
- Subclass Phenyltropanes
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Class
Tropane alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Tropane alkaloids
Subclass
Phenyltropanes
Intermediate Tree Nodes
Not available
Direct Parent
Phenyltropanes
Alternative Parents
Macrolactams Phenylpiperidines Beta amino acids and derivatives Piperidinecarboxylic acids Toluenes Aralkylamines N-alkylpyrrolidines Trialkylamines Carboxylic acid esters Organic transition metal salts Azacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Carbene-type 1,3-dipolar compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic zwitterions
Molecular Framework
Not available
Substituents
Phenyltropane - Macrolactam - Phenylpiperidine - Beta amino acid or derivatives - Piperidinecarboxylic acid - Aralkylamine - Toluene - Monocyclic benzene moiety - Piperidine - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Monocarboxylic acid or derivatives - Organic transition metal salt - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carbene-type 1,3-dipolar compound - Secondary amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Amine - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyltropanes. These are compounds containing a phenyl group linked to a tropane moiety. Tropane is an organonitrogenous [3.2.1] bicyclic organic compound.
External Descriptors
Not available