Compound Identification
SMILES
NCCSSCCC(=O)NCC#CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)C2=C1C(N)=NC=N2
InChIKey
InChIKey=HXCGIYSTHRYTHO-SQWLQELKSA-N
Formula
C19H29N6O13P3S2
Mass
706.51
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolopyrimidines
- Subclass Pyrrolo[2,3-d]pyrimidines
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Class
Pyrrolopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Pyrrolo[2,3-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolo[2,3-d]pyrimidines
Alternative Parents
Aminopyrimidines and derivatives Monoalkyl phosphates Substituted pyrroles Imidolactams Heteroaromatic compounds Oxolanes Secondary alcohols Secondary carboxylic acid amides Amino acids and derivatives Dialkyldisulfides Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolo[2,3-d]pyrimidine - Aminopyrimidine - Monoalkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Substituted pyrrole - Alkyl phosphate - Imidolactam - Heteroaromatic compound - Oxolane - Pyrrole - Dialkyldisulfide - Carboxamide group - Organic disulfide - Amino acid or derivatives - Secondary alcohol - Secondary carboxylic acid amide - Sulfenyl compound - Azacycle - Oxacycle - Carboxylic acid derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Alcohol - Carbonyl group - Primary aliphatic amine - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.
External Descriptors
Not available