Compound Identification
SMILES
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)CN(CCN(CCC#N)C(=S)NCCC2=CC=CC=C2)[C@H](C)[C@@H](O)[C@]1(C)O
InChIKey
InChIKey=KRNRYEYQCZEYEY-JSTPAELBSA-N
Formula
C51H87N5O12S
Mass
994.34
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
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Aminosaccharides
- Level 6 Aminoglycosides
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Level 5
Aminosaccharides
-
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
Aminosaccharides
Direct Parent
Aminoglycosides
Alternative Parents
O-glycosyl compounds Oxanes Benzene and substituted derivatives Monosaccharides Tertiary alcohols Trialkylamines Thioureas Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Carboxylic acid esters Lactones Polyols Acetals Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Nitriles Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminoglycoside core - Glycosyl compound - O-glycosyl compound - Monocyclic benzene moiety - Monosaccharide - Oxane - Benzenoid - Tertiary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Lactone - Secondary alcohol - Tertiary amine - Thiourea - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Acetal - Polyol - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Organopnictogen compound - Cyanide - Amine - Carbonyl group - Organic oxide - Alcohol - Hydrocarbon derivative - Organonitrogen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminoglycosides. These are molecules or a portion of a molecule composed of amino-modified sugars.
External Descriptors
Not available