Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CCCCN1C=C2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N(C)C3CCCCCC3)C3=C2C1=CC=C3
InChIKey
InChIKey=BNYWABBIVPYJMB-QYUCOSTDSA-N
Formula
C34H49N3O8
Mass
627.779
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Ergoline and derivatives
- Subclass Lysergic acids and derivatives
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Class
Ergoline and derivatives
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ergoline and derivatives
Subclass
Lysergic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Lysergic acids and derivatives
Alternative Parents
Indoloquinolines Benzoquinolines Pyrroloquinolines Quinoline-3-carboxamides 3-alkylindoles N-alkylindoles Piperidinecarboxamides Isoindoles and derivatives Tricarboxylic acids and derivatives Aralkylamines Substituted pyrroles Alpha hydroxy acids and derivatives Benzenoids Tertiary carboxylic acid amides Tertiary alcohols Heteroaromatic compounds Trialkylamines Amino acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Not available
Substituents
Lysergic acid or derivatives - Indoloquinoline - Benzoquinoline - Quinoline-3-carboxamide - Pyrroloquinoline - N-alkylindole - 3-alkylindole - Quinoline - Indole - Indole or derivatives - Isoindole or derivatives - 3-piperidinecarboxamide - Piperidinecarboxamide - Tricarboxylic acid or derivatives - Aralkylamine - Alpha-hydroxy acid - Hydroxy acid - Benzenoid - Piperidine - Substituted pyrrole - Pyrrole - Tertiary alcohol - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Amine - Alcohol - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lysergic acids and derivatives. These are alkaloids with a structure based on the lysergic acid skeleton.
External Descriptors
Not available