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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H11ClN5O6P.2H4N
Molecular Weight 399.728
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLADRIBINE 5'-MONOPHOSPHATE DIAMMONIUM

SMILES

[NH4+].[NH4+].NC1=NC(Cl)=NC2=C1N=CN2[C@H]3C[C@H](O)[C@@H](COP([O-])([O-])=O)O3

InChI

InChIKey=XGWMWBRVXIGUPS-FVALZTRZSA-N
InChI=1S/C10H13ClN5O6P.2H3N/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(17)5(22-6)2-21-23(18,19)20;;/h3-6,17H,1-2H2,(H2,12,14,15)(H2,18,19,20);2*1H3/t4-,5+,6+;;/m0../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CLADRIBINE 5'-MONOPHOSPHATE DIAMMONIUM
Common Name English
5'-ADENYLIC ACID, 2-CHLORO-2'-DEOXY-, DIAMMONIUM SALT
Systematic Name English
2-CHLORO-2'-DEOXY-5'-ADENYLIC ACID DIAMMONIUM
Systematic Name English
Code System Code Type Description
FDA UNII
ACG7003W3B
Created by admin on Fri Dec 15 15:47:02 GMT 2023 , Edited by admin on Fri Dec 15 15:47:02 GMT 2023
PRIMARY
CAS
104959-35-5
Created by admin on Fri Dec 15 15:47:02 GMT 2023 , Edited by admin on Fri Dec 15 15:47:02 GMT 2023
PRIMARY
PUBCHEM
88598300
Created by admin on Fri Dec 15 15:47:02 GMT 2023 , Edited by admin on Fri Dec 15 15:47:02 GMT 2023
PRIMARY