Compound Identification
SMILES
CC(C)C[C@H](CC(=O)N[C@H](CC(=O)N[C@@H](C)CC(=O)N[C@@H](C)CC(=O)N[C@@H](CCCN)CC(O)=O)CC1=CC=CC=C1)NC(=O)C[C@H](CCCN=C(N)N)NC(=O)C[C@H](C)NC(=S)NC1=CC(C(O)=O)=C(C=C1)C1=C2C=CC(=O)C=C2OC2=C1C=CC(O)=C2
InChIKey
InChIKey=CRXKXMINNZHCPP-XOFKSGHUSA-N
Formula
C63H84N12O13S
Mass
1249.5
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
-
Subclass
1-benzopyrans
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Level 5
Dibenzopyrans
- Level 6 Xanthenes
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Level 5
Dibenzopyrans
-
Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans
Direct Parent
Xanthenes
Alternative Parents
Beta amino acids and derivatives Amphetamines and derivatives N-phenylthioureas Benzoic acids Benzoyl derivatives Medium-chain fatty acids 1-hydroxy-2-unsubstituted benzenoids Amino fatty acids Branched fatty acids Heterocyclic fatty acids Hydroxy fatty acids N-acyl amines Heteroaromatic compounds Thioureas Guanidines Cyclic ketones Amino acids Secondary carboxylic acid amides Carboxylic acids Carboximidamides Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Beta amino acid or derivatives - Amphetamine or derivatives - N-phenylthiourea - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Medium-chain fatty acid - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Amino fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Branched fatty acid - Fatty amide - Benzenoid - N-acyl-amine - Monocyclic benzene moiety - Fatty acid - Fatty acyl - Heteroaromatic compound - Carboxamide group - Amino acid or derivatives - Guanidine - Amino acid - Cyclic ketone - Thiourea - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Carboximidamide - Carboxylic acid derivative - Oxacycle - Amine - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
External Descriptors
Not available