Compound Identification
SMILES
CC(NC1=CC=C(CC(O)C(O)C(O)COC2OC(COP(O)(=O)OC(CCC(O)=O)C(O)=O)C(O)C2O)C=C1)C1C(C)NC2=C(N1C)C(=O)N=C(N)N2
InChIKey
InChIKey=SWBKYDXMQNCIAW-UHFFFAOYSA-N
Formula
C31H47N6O16P
Mass
790.717
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
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Subclass
Carbohydrates and carbohydrate conjugates
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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
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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 Dialkylarylamines Aniline and substituted anilines Phenylalkylamines Aminopyrimidines and derivatives Dialkyl phosphates Secondary alkylarylamines Pyrimidones Dicarboxylic acids and derivatives Heteroaromatic compounds Vinylogous amides Tetrahydrofurans Amino acids Secondary alcohols Acetals Polyols Oxacyclic compounds Azacyclic compounds Carboxylic acids Primary amines Carbonyl compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
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 - Pteridine - Monosaccharide phosphate - Phenylalkylamine - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Dialkyl phosphate - Alkyl phosphate - Benzenoid - Organic phosphoric acid derivative - Dicarboxylic acid or derivatives - Phosphoric acid ester - Fatty acyl - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Tetrahydrofuran - Secondary alcohol - Amino acid - Amino acid or derivatives - Tertiary amine - Polyol - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Acetal - Secondary amine - Amine - Carbonyl group - Organic oxide - Primary amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Alcohol - 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