Compound Identification
SMILES
CCN1C[C@]2(COC(=O)C3=CC=CC=C3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]2C[C@@](O)(C13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@]1(O)[C@H]2OC
InChIKey
InChIKey=IUJWSEFNAUXHTB-PEOOALOTSA-N
Formula
C33H46N2O10
Mass
630.735
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
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 Benzoic acid esters Acetanilides Quinolidines N-acetylarylamines Alkaloids and derivatives Benzoyl derivatives Azepanes Piperidines Acetamides Vinylogous amides Tertiary alcohols 1,2-aminoalcohols Amino acids and derivatives Cyclic alcohols and derivatives Carboxylic acid esters Secondary carboxylic acid amides Trialkylamines Polyols Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aconitane-type diterpenoid alkaloid - Acylaminobenzoic acid or derivatives - Acetanilide - Benzoate ester - Quinolidine - N-acetylarylamine - Benzoic acid or derivatives - Alkaloid or derivatives - Anilide - Benzoyl - N-arylamide - Azepane - Piperidine - Monocyclic benzene moiety - Benzenoid - Cyclic alcohol - Tertiary alcohol - Acetamide - Vinylogous amide - Carboxylic acid ester - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Dialkyl ether - Ether - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Organopnictogen 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
CHEBI:5061 : diterpenoid