Compound Identification
SMILES
CCN(CC)C1=CC2=C(C=C1)C(C1=C(C)C=C(NC(=S)NOCC3CN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN3CC(O)=O)C=C1)=C1C=CC(C=C1O2)=[N+](CC)CC
InChIKey
InChIKey=HRULIJNURGHHNP-UHFFFAOYSA-O
Formula
C46H63N8O10S
Mass
920.12
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
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Level 5
Dibenzopyrans
- Level 6 Xanthenes
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Level 5
Dibenzopyrans
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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
Tetracarboxylic acids and derivatives Alpha amino acids Dialkylarylamines Toluenes Secondary ketimines Heteroaromatic compounds Trialkylamines Amino acids Oxacyclic compounds Azacyclic compounds Carboxylic acids Organosulfur compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Tetracarboxylic acid or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Toluene - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Secondary ketimine - Amino acid or derivatives - Amino acid - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Amine - Organic oxide - Organic cation - 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