Compound Identification
SMILES
CC(C)[N@@+]1(\C(=C/C(O)=O)C(O)=O)C(C[C@H]2CCCO2)=C2C[C@H]3N(C)C[C@@H](C=C3C3=C2C1=CC=C3)C(O)=O
InChIKey
InChIKey=XGAJVGHIQOJZDU-MVWCLVCLSA-O
Formula
C28H33N2O7
Mass
509.578
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Alkaloids and derivatives
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Class
Ergoline and derivatives
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Subclass
Lysergic acids and derivatives
- Level 5 Lysergic acids
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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
Alternative Parents
6,7-secoergolines Benzoquinolines Quinoline carboxylic acids Alpha amino acids Tetralins Tricarboxylic acids and derivatives Indoles and derivatives Isoindoles and derivatives Oxolanes Amino acids Trialkylamines Dialkyl ethers Carboxylic acids Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lysergic acid - 6,7-secoergoline - Benzoquinoline - Quinoline-3-carboxylic acid - Alpha-amino acid - Alpha-amino acid or derivatives - Quinoline - Tetralin - Indole or derivatives - Isoindole or derivatives - Tricarboxylic acid or derivatives - Benzenoid - Oxolane - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Amino acid - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Oxacycle - Carboxylic acid - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lysergic acids. These are derivatives of lysergic acid are amides in which the amidic moiety is formed by a small peptide or an alkylamide.
External Descriptors
Not available