Compound Identification
SMILES
CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC1=CN([C@H]2C[C@H](OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H](O)CN3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=CN=C4N)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)[C@@H](COCC3=CC(OCC4=CC=CC=C4)=C(OCC4=CC=CC=C4)C=C3)O2)C(=O)NC1=O
InChIKey
InChIKey=ODMFMKPTIKTFTN-BIFLLIEOSA-N
Formula
C125H192N38O41P6
Mass
3068.979
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
Ribonucleoside 3'-phosphates 6-aminopurines 6-oxopurines Hypoxanthines Benzylethers Phenoxy compounds Phenol ethers Alkyl aryl ethers Aminopyrimidines and derivatives Pyrimidones Dialkyl phosphates Hydropyrimidines Imidolactams N-substituted imidazoles Oxolanes Vinylogous amides Heteroaromatic compounds Quaternary ammonium salts Trialkylamines Lactams Ureas Secondary alcohols Dialkyl ethers Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Primary amines Organic oxides Organic zwitterions
Molecular Framework
Not available
Substituents
Purine deoxyribonucleoside 3',5'-bisphosphate - Ribonucleoside 3'-phosphate - 6-aminopurine - 6-oxopurine - Hypoxanthine - Benzylether - Imidazopyrimidine - Purine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - Dialkyl phosphate - Monocyclic benzene moiety - Hydropyrimidine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Pyrimidine - Benzenoid - Alkyl phosphate - Vinylogous amide - Oxolane - Quaternary ammonium salt - Azole - Heteroaromatic compound - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Lactam - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxygen compound - Primary amine - Alcohol - Amine - 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