Compound Identification
SMILES
OC[C@@H](O)[C@@H](O)CC1=CN=C(C=N1)[C@@H](O)[C@H](O)[C@H](O)CO.CC1=C(O)C(C)=C2CCC(C)(COC3=CC=C(CC4SC(=O)NC4=O)C=C3)OC2=C1C
InChIKey
InChIKey=MUCQBHZYTOFZIV-JBLFJNHSSA-N
Formula
C36H47N3O12S
Mass
745.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
- Subclass 1-benzopyrans
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Class
Benzopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Phenol ethers Phenoxy compounds Alkyl aryl ethers Thiazolidinediones Phenols Sugar alcohols Pyrazines Dicarboximides Heteroaromatic compounds Thiocarbamic acid derivatives 1,2-diols Secondary alcohols Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols Primary alcohols
Molecular Framework
Not available
Substituents
1-benzopyran - Phenoxy compound - Phenol ether - Alkyl aryl ether - Phenol - Thiazolidinedione - Monocyclic benzene moiety - Benzenoid - Pyrazine - Sugar alcohol - Dicarboximide - Heteroaromatic compound - Thiazolidine - 1,2-diol - Thiocarbamic acid derivative - Secondary alcohol - Carboxylic acid derivative - Ether - Oxacycle - Azacycle - Polyol - Organooxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Primary alcohol - Aromatic alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available