Compound Identification
SMILES
COC1=C(O)C=CC(=C1)C(=O)O[C@]1(C[C@H](O)[C@@H](N)[C@@H](O1)[C@H](O)[C@H](O)CO)C(O)=O
InChIKey
InChIKey=LEHJVXSZBPMTFV-CXUXTSSLSA-N
Formula
C17H23NO11
Mass
417.367
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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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Level 6
Sugar amino acids and derivatives
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Level 7
Pyranoid amino acids and derivatives
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Level 8
Neuraminic acids and derivatives
- Level 9 Neuraminic acids
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Level 8
Neuraminic acids and derivatives
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Level 7
Pyranoid amino acids and derivatives
-
Level 6
Sugar amino acids and derivatives
-
Level 5
Sugar acids and derivatives
-
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 - Pyranoid amino acids and derivatives - Neuraminic acids and derivatives
Direct Parent
Neuraminic acids
Alternative Parents
Aminoglycosides C-glucuronides Delta amino acids and derivatives p-Hydroxybenzoic acid alkyl esters C-glycosyl compounds M-methoxybenzoic acids and derivatives Methoxyphenols Anisoles Benzoyl derivatives Phenoxy compounds Methoxybenzenes Ketals 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Pyrans Oxanes Dicarboxylic acids and derivatives 1,3-aminoalcohols Carboxylic acid esters Secondary alcohols 1,2-aminoalcohols Amino acids Oxacyclic compounds Carboxylic acids Polyols Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminoglycoside core - Neuraminic acid - C-glucuronide - Delta amino acid or derivatives - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - C-glycosyl compound - Glycosyl compound - M-methoxybenzoic acid or derivatives - Benzoate ester - Methoxyphenol - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Amino saccharide - Ketal - Phenol - Dicarboxylic acid or derivatives - Benzenoid - Pyran - Monocyclic benzene moiety - Oxane - 1,3-aminoalcohol - Amino acid or derivatives - 1,2-aminoalcohol - Secondary alcohol - Carboxylic acid ester - Amino acid - Acetal - Oxacycle - Organoheterocyclic compound - Polyol - Ether - Carboxylic acid derivative - Carboxylic acid - Primary alcohol - Primary amine - Organic nitrogen compound - Organopnictogen compound - Alcohol - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Carbonyl group - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as neuraminic acids. These are carbohydrate derivatives containing a neuraminic acid moiety.
External Descriptors
Not available