Compound Identification
SMILES
[H][C@]12C[C@@]3([H])[C@@]4(CCC[C@@]3(C)CN(C)[C@]14[H])[C@]1([H])C[C@]3([H])CC[C@]21[C@]([H])(OC(=O)C1=CC(OC)=C(OC)C=C1)[C@]3(O)COC(C)=O
InChIKey
InChIKey=KTVHQYRUFIKEDO-GOFMXOGOSA-N
Formula
C32H43NO7
Mass
553.696
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
Villanovane, atisane, trachylobane or helvifulvane diterpenoids - Atisane diterpenoids
Direct Parent
Danudatine-type diterpenoid alkaloids
Alternative Parents
P-methoxybenzoic acids and derivatives M-methoxybenzoic acids and derivatives Benzoic acid esters Dimethoxybenzenes Alkaloids and derivatives Anisoles Phenoxy compounds Benzoyl derivatives Alkyl aryl ethers Azepanes Piperidines Dicarboxylic acids and derivatives Tertiary alcohols Carboxylic acid esters Trialkylamines Amino acids and derivatives Cyclic alcohols and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Danudatine-type diterpenoid alkaloid - M-methoxybenzoic acid or derivatives - P-methoxybenzoic acid or derivatives - Benzoate ester - Dimethoxybenzene - O-dimethoxybenzene - Alkaloid or derivatives - Benzoic acid or derivatives - Anisole - Methoxybenzene - Benzoyl - Phenol ether - Phenoxy compound - Azepane - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Piperidine - Dicarboxylic acid or derivatives - Cyclic alcohol - Tertiary alcohol - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Tertiary amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Ether - Organopnictogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alcohol - Organic oxygen compound - Amine - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as danudatine-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the danudatine skeleton, which is a hexacyclic compound with an additional C-20-C7 bond in the atisine skeleton.
External Descriptors
Not available