Compound Identification
SMILES
CC(C)OC1=NC=C(NC(=O)OCC2=CN(N=N2)C2=CC(C(F)F)=C(O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O3)[C@H](O)[C@H](O)CO)C(O)=O)C=C2)C=C1
InChIKey
InChIKey=OZAFNAHXSKZGSK-QNZCFMPVSA-N
Formula
C30H36F2N6O12
Mass
710.645
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
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
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Level 9
N-acylneuraminic acids and derivatives
- Level 10 N-acylneuraminic acids
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Level 9
N-acylneuraminic acids and derivatives
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Level 8
Neuraminic acids and derivatives
-
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 - N-acylneuraminic acids and derivatives
Direct Parent
N-acylneuraminic acids
Alternative Parents
Neuraminic acids C-glucuronides C-glycosyl compounds Phenyl-1,2,3-triazoles Phenoxyacetic acid derivatives Phenol ethers Phenoxy compounds Ketals Alkyl aryl ethers Pyridines and derivatives Pyrans Oxanes Acetamides Heteroaromatic compounds Carbamate esters Secondary alcohols Secondary carboxylic acid amides Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Oxacyclic compounds Polyols Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Alkyl fluorides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acylneuraminic acid - Neuraminic acid - C-glucuronide - Phenoxyacetate - C-glycosyl compound - Phenyltriazole - Glycosyl compound - Phenyl-1,2,3-triazole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Ketal - Benzenoid - Oxane - Monocyclic benzene moiety - Pyran - Pyridine - Azole - Heteroaromatic compound - Acetamide - Triazole - 1,2,3-triazole - Carbamic acid ester - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Polyol - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Alcohol - Alkyl halide - Organopnictogen compound - Organic oxide - Primary alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acylneuraminic acids. These are neuraminic acids carrying an N-acyl substituent.
External Descriptors
Not available