Compound Identification
SMILES
CCN1C[C@]2(COC(=O)C3=CC=CC=C3NC(C)=O)CC[C@@H](OC)[C@@]34C5C[C@H]6C(OC(C)=O)C5[C@](O)(C[C@@H]6OC)C(O)(C(OC)C23)C14
InChIKey
InChIKey=QFEWDYKEKVVRHZ-CEZPZZPFSA-N
Formula
C35H48N2O10
Mass
656.773
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 Acetanilides Quinolidines Benzoic acid esters Alkaloids and derivatives N-acetylarylamines Benzoyl derivatives Azepanes Piperidines Dicarboxylic acids and derivatives Vinylogous amides Acetamides Tertiary alcohols 1,2-aminoalcohols 1,2-diols Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Cyclic alcohols and derivatives Carboxylic acid esters Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aconitane-type diterpenoid alkaloid - Acylaminobenzoic acid or derivatives - Acetanilide - Benzoate ester - Quinolidine - Benzoic acid or derivatives - N-acetylarylamine - Alkaloid or derivatives - Anilide - Benzoyl - N-arylamide - Azepane - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Piperidine - Benzenoid - Cyclic alcohol - Acetamide - Vinylogous amide - Tertiary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - 1,2-diol - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Ether - Azacycle - Organoheterocyclic compound - Dialkyl ether - Carboxylic acid derivative - Alcohol - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Organonitrogen compound - Organooxygen compound - 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