Compound Identification
SMILES
CC1=CN(C2CC(OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)N3C=CC(N)=NC3=O)N3C=C(C)C(=O)NC3=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)C(COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OCCCNC(=O)\C=C\C3=CNC=N3)N3C=NC4=C3N=CN=C4N)N3C=CC(N)=NC3=O)N3C=CC(N)=NC3=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)N3C=NC4=C3N=CN=C4N)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)N3C=CC(N)=NC3=O)O2)C(=O)NC1=O
InChIKey
InChIKey=AKRRSRPZSUFVCD-SNAWJCMRSA-N
Formula
C171H219N66O101P17
Mass
5341.548
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
- Class Purine nucleotides
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Superclass
Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Purine nucleotides
Subclass
Purine deoxyribonucleotides
Intermediate Tree Nodes
Purine deoxyribonucleoside bisphosphates
Direct Parent
Purine deoxyribonucleoside 3',5'-bisphosphates
Alternative Parents
Polysaccharide phosphates Pyrimidine deoxyribonucleoside 3',5'-bisphosphates Pyrimidine 2'-deoxyribonucleoside monophosphates Ribonucleoside 3'-phosphates 6-aminopurines 6-oxopurines Hypoxanthines Aminopyrimidines and derivatives Dialkyl phosphates Pyrimidones N-substituted imidazoles Imidolactams Hydropyrimidines Oxolanes Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Secondary alcohols Lactams Secondary carboxylic acid amides Ureas Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary amines Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Polysaccharide phosphate - Polysaccharide - Purine deoxyribonucleoside 3',5'-bisphosphate - Pyrimidine deoxyribonucleoside 3',5'-bisphosphate - Pyrimidine deoxyribonucleoside bisphosphate - Pyrimidine 2'-deoxyribonucleoside monophosphate - Ribonucleoside 3'-phosphate - 6-aminopurine - 6-oxopurine - Hypoxanthine - Imidazopyrimidine - Purine - Aminopyrimidine - Dialkyl phosphate - Pyrimidone - Hydropyrimidine - Alkyl phosphate - Pyrimidine - N-substituted imidazole - Imidolactam - Organic phosphoric acid derivative - Phosphoric acid ester - Imidazole - Vinylogous amide - Azole - Oxolane - Heteroaromatic compound - Carboxamide group - Amino acid or derivatives - Secondary alcohol - Urea - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Azacycle - Alcohol - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Primary amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purine deoxyribonucleoside 3',5'-bisphosphates. These are purine ribobucleotides with one phosphate group attached to each of two different hydroxyl groups of the ribose moiety, which lacks a hydroxyl group at position 2.
External Descriptors
Not available