Compound Identification
SMILES
CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC)[C@]13[C@@H]4C[C@H]2[C@H]1N(CC)C[C@]4(COC(=O)C1=CC=CC=C1NC(C)=O)CC[C@@H]3OC
InChIKey
InChIKey=VTGZZJPGHNWGGI-OCZJDJGNSA-N
Formula
C35H50N2O7
Mass
610.792
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
- Subclass Diterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
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
Acylaminobenzoic acid and derivatives Acetanilides Quinolidines Benzoic acid esters N-acetylarylamines Alkaloids and derivatives Benzoyl derivatives Azepanes Piperidines Vinylogous amides Acetamides Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aconitane-type diterpenoid alkaloid - Acylaminobenzoic acid or derivatives - Acetanilide - Quinolidine - Benzoate ester - N-acetylarylamine - Anilide - Alkaloid or derivatives - Benzoic acid or derivatives - Benzoyl - N-arylamide - Azepane - Piperidine - Benzenoid - Monocyclic benzene moiety - Acetamide - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Ether - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - 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