Compound Identification
SMILES
C[C@@H](NC1=CC=C(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]2O[C@H](COP([O-])(=O)O[C@@H](CCC([O-])=O)C([O-])=O)[C@@H](O)[C@H]2O)C=C1)C1C(C)NC2=C(C(=O)N=C(N)N2)[N+]1=C
InChIKey
InChIKey=LPIWYGCHPICAME-DQEUQOBYSA-L
Formula
C31H43N6O16P
Mass
786.686
Taxonomic Classification
Taxonomy Tree
-
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
Monosaccharides
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Level 6
Pentoses
- Level 7 Pentose phosphates
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Level 6
Pentoses
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Level 5
Monosaccharides
-
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
Monosaccharides - Pentoses
Direct Parent
Pentose phosphates
Alternative Parents
Fatty acyl glycosides of mono- and disaccharides Alkyl glycosides Pterins and derivatives O-glycosyl compounds Monosaccharide phosphates Aniline and substituted anilines Phenylalkylamines Aminopyrimidines and derivatives Dialkyl phosphates Pyrimidones Secondary alkylarylamines Primary aromatic amines Dicarboxylic acids and derivatives Vinylogous amides Oxolanes Heteroaromatic compounds Amino acids Carboxylic acid salts Secondary alcohols Oxacyclic compounds Polyols Acetals Azacyclic compounds Carboxylic acids Organic salts Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pentose phosphate - Pentose-5-phosphate - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Alkyl glycoside - Pterin - Glycosyl compound - O-glycosyl compound - Monosaccharide phosphate - Pteridine - Phenylalkylamine - Aniline or substituted anilines - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Dialkyl phosphate - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Organic phosphoric acid derivative - Fatty acyl - Phosphoric acid ester - Primary aromatic amine - Pyrimidine - Benzenoid - Alkyl phosphate - Oxolane - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Secondary alcohol - Amino acid - Carboxylic acid salt - Secondary amine - Acetal - Polyol - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organopnictogen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic salt - Amine - Primary amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups.
External Descriptors
Not available