Compound Identification
SMILES
NC1=NC2=C(N=CN2[C@H]2C[C@H](OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(S)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(O)(S)=S)N3C=CC(N)=NC3=O)N3C=NC4=C3N=C(N)NC4=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=C(N)NC4=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=C(N)NC4=O)N3C=CC(N)=NC3=O)[C@@H](CO)O2)C(=O)N1
InChIKey
InChIKey=WEHBTNCILYGDGY-RTGBKZERSA-N
Formula
C76H98N32O33P8S16
Mass
2748.56
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
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Level 5
Purinones
- Level 6 Hypoxanthines
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Level 5
Purinones
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Purinones
Direct Parent
Hypoxanthines
Alternative Parents
6-oxopurines Pyrimidones Aminopyrimidines and derivatives Phosphorodithioic acid O,O-diesters Phosphorodithioic acid O-monoesters N-substituted imidazoles Imidolactams Hydropyrimidines Vinylogous amides Oxolanes Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary alcohols Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-oxopurine - Hypoxanthine - Pyrimidone - Phosphorodithioic acid o,o-diester - Aminopyrimidine - Dithiophosphate o-ester - Hydropyrimidine - N-substituted imidazole - Imidolactam - Pyrimidine - Phosphorodithioic acid o-monoester - Heteroaromatic compound - Imidazole - Vinylogous amide - Organic dithiophosphate - Oxolane - Azole - Lactam - Oxacycle - Azacycle - Primary alcohol - Primary amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available