Compound Identification
SMILES
CCNC1=CC2=C(C=C1)C(=C1C=CC(C=C1O2)=NCC)C1=C(C=C(C=C1)C(=O)NCC1=CC(C(C)OC(=O)NCC#CC2=CN([C@H]3C[C@H](OCOC)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O3)C(=O)N=C2N)=C(C=C1)[N+]([O-])=O)C(O)=O
InChIKey
InChIKey=QKZTYSZNQLXGEY-ZFAPLZSOSA-N
Formula
C49H53N8O22P3
Mass
1198.918
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Pyrimidine nucleotides
Subclass
Pyrimidine deoxyribonucleotides
Intermediate Tree Nodes
Pyrimidine deoxyribonucleoside triphosphates
Direct Parent
Pyrimidine 2'-deoxyribonucleoside triphosphates
Alternative Parents
N-benzylbenzamides Xanthenes Benzyloxycarbonyls Nitrobenzenes Benzoic acids Benzoyl derivatives Nitroaromatic compounds Aminopyrimidines and derivatives Monoalkyl phosphates Pyrimidones Secondary alkylarylamines Primary aromatic amines Imidolactams Hydropyrimidines Oxolanes Carbamate esters Heteroaromatic compounds Secondary ketimines Amino acids Secondary carboxylic acid amides Acetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids Monocarboxylic acids and derivatives Organopnictogen compounds Carbonyl compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidine 2'-deoxyribonucleoside triphosphate - N-benzylbenzamide - Dibenzopyran - Xanthene - Benzyloxycarbonyl - 1-benzopyran - Benzopyran - Benzamide - Benzoic acid or derivatives - Benzoic acid - Nitrobenzene - Benzoyl - Nitroaromatic compound - Pyrimidone - Secondary aliphatic/aromatic amine - Aminopyrimidine - Monoalkyl phosphate - Phosphoric acid ester - Organic phosphoric acid derivative - Primary aromatic amine - Pyrimidine - Monocyclic benzene moiety - Imidolactam - Alkyl phosphate - Hydropyrimidine - Benzenoid - Secondary ketimine - Carbamic acid ester - Oxolane - Heteroaromatic compound - Secondary carboxylic acid amide - Organic nitro compound - Amino acid or derivatives - Carboxamide group - Amino acid - C-nitro compound - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Secondary amine - Organic oxoazanium - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Organic salt - Primary amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidine 2'-deoxyribonucleoside triphosphates. These are pyrimidine nucleotides with a triphosphate group linked to the ribose moiety lacking a hydroxyl group at position 2.
External Descriptors
Not available