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)[C@@H]1NC2=C(N[C@H]1C)NC(N)=NC2=O
InChIKey
InChIKey=SCBIBGUJSMHIAI-LHIIQLEZSA-K
Formula
C30H42N6O16P
Mass
773.667
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Monosaccharides
-
Level 6
Pentoses
- Level 7 Pentose phosphates
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Level 6
Pentoses
-
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 Pterins and derivatives Alkyl glycosides O-glycosyl compounds Monosaccharide phosphates Aniline and substituted anilines Phenylalkylamines Secondary alkylarylamines Dialkyl phosphates Aminopyrimidines and derivatives Pyrimidones Dicarboxylic acids and derivatives Vinylogous amides Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Amino acids Acetals Polyols Oxacyclic compounds Azacyclic compounds Carboxylic acids Primary amines Carbonyl compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Organic anions
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 - Aniline or substituted anilines - Phenylalkylamine - Pyrimidone - Secondary aliphatic/aromatic amine - Aminopyrimidine - Dialkyl phosphate - Alkyl phosphate - Organic phosphoric acid derivative - Monocyclic benzene moiety - Phosphoric acid ester - Pyrimidine - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Tetrahydrofuran - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Secondary alcohol - Amino acid - Polyol - Oxacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Acetal - Amine - Primary amine - Carbonyl group - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organic anion - 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
CHEBI:58103 : dicarboxylic acid dianion - organophosphate oxoanion