Compound Identification
SMILES
COC(=O)C1=CC=C(CN2CCCN(CC2)C(=S)NC2=CC=CC=C2SC)O1
InChIKey
InChIKey=XBUDEFFYRJMRAS-UHFFFAOYSA-N
Formula
C20H25N3O3S2
Mass
419.56
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar acids and derivatives
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Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Furanoid amino acids and derivatives
Alternative Parents
N-phenylthioureas Furoic acid esters Thiophenol ethers 1,4-diazepanes Alkylarylthioethers Aralkylamines Methyl esters Heteroaromatic compounds Trialkylamines Thioureas Amino acids and derivatives Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furanoid amino acid - N-phenylthiourea - Furoic acid ester - Furoic acid or derivatives - Aryl thioether - Thiophenol ether - 1,4-diazepane - Diazepane - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Furan - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Thiourea - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Thioether - Sulfenyl compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as furanoid amino acids and derivatives. These are sugar amino acids containing a furan ring.
External Descriptors
Not available