Structure Information
Structure

Compound Identification

SMILES

CCN1C[C@]2(COC(=O)C3=CC=CC=C3NC(=O)CCC(=O)OC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14

InChIKey

InChIKey=SVMCGAKQNRLCHV-VSNJHZSNSA-N

Formula

C37H52N2O11

Mass

700.826

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Aconitane-type diterpenoid alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aconitane-type diterpenoid alkaloid - Acylaminobenzoic acid or derivatives - Quinolidine - Benzoate ester - Alkaloid or derivatives - Anilide - Benzoic acid or derivatives - Benzoyl - N-arylamide - Fatty acid ester - Azepane - Fatty acid methyl ester - Piperidine - Dicarboxylic acid or derivatives - Fatty acyl - Fatty amide - Benzenoid - Monocyclic benzene moiety - Cyclic alcohol - Vinylogous amide - Methyl ester - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - 1,2-diol - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - 1,2-aminoalcohol - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Azacycle - Dialkyl ether - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Amine - Organonitrogen compound - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aconitane-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hexacyclic aconitane skeleton. These compounds have no oxygen functionality at the C7 atom.

External Descriptors

Not available

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