Compound Identification
SMILES
Cl.CN1C=C(NCCCCN2C(=O)N=C3N(C)C4=C(C=C(C)C(C)=C4)N=C3C2=O)C=C1C(=O)NC1=CN(C)C(=C1)C(=O)NC1=CN(C)C(=C1)C(=O)NCCC(N)=N
InChIKey
InChIKey=VEMMPENOCDDBKC-UHFFFAOYSA-N
Formula
C38H46ClN13O5
Mass
800.32
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pteridines and derivatives
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Subclass
Alloxazines and isoalloxazines
- Level 5 Flavins
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Subclass
Alloxazines and isoalloxazines
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Class
Pteridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Alloxazines and isoalloxazines
Intermediate Tree Nodes
Not available
Direct Parent
Flavins
Alternative Parents
Quinoxalines 2-heteroaryl carboxamides Pyrrole carboxamides Pyrimidones Secondary alkylarylamines Benzenoids N-methylpyrroles Pyrazines Heteroaromatic compounds Vinylogous amides Amino acids and derivatives Lactams Secondary carboxylic acid amides Carboximidamides Carboxamidines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavin - Quinoxaline - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Pyrimidone - Secondary aliphatic/aromatic amine - N-methylpyrrole - Pyrazine - Pyrimidine - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Vinylogous amide - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Secondary amine - Azacycle - Amidine - Carboximidamide - Carboxylic acid amidine - Carboxylic acid derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavins. These are compounds containing a flavin (7,8-dimethyl-benzo[g]pteridine-2,4-dione) moiety, with a structure characterized by an isoalloaxzine tricyclic ring.
External Descriptors
Not available