Compound Identification
SMILES
[H]\C(C)=C1/CN2[C@@]3([H])C[C@]1([H])[C@](COC[C@@]1([H])O[C@@]([H])(O)[C@]([H])(O)[C@@]([H])(O)[C@]1([H])O)(C(=O)OC)[C@]2([H])CC1=C3NC2=CC=CC=C12
InChIKey
InChIKey=OFKKMIJEGPAGLG-RAVNQUILSA-N
Formula
C27H34N2O8
Mass
514.575
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Macroline alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Macroline alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Macroline alkaloids
Alternative Parents
Corynanthean-type alkaloids Vobasan alkaloids Beta carbolines 3-alkylindoles Piperidinecarboxylic acids Quinuclidines Aralkylamines Monosaccharides Oxanes Benzenoids Heteroaromatic compounds Methyl esters Pyrroles Hemiacetals Secondary alcohols Trialkylamines Amino acids and derivatives Polyols Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macroline skeleton - Corynanthean skeleton - Vobasan skeleton - Beta-carboline - Pyridoindole - 3-alkylindole - Piperidinecarboxylic acid - Indole - Indole or derivatives - Quinuclidine - Aralkylamine - Piperidine - Oxane - Monosaccharide - Benzenoid - Heteroaromatic compound - Pyrrole - Methyl ester - Hemiacetal - Carboxylic acid ester - Amino acid or derivatives - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Polyol - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alcohol - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as macroline alkaloids. These are alkaloids with a structure that is based on the tetracyclic macroline skeleton. The macroline skeleton arises by scission of the C-21 to N-4 bond of the akuammilan skeleton, and mostly occurs in bisindole alkaloids.
External Descriptors
Not available