CLADRIBINE 5'-MONOPHOSPHATE DIAMMONIUM

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

Structure Search

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

Molecular Formula	H3N
Molecular Weight	17.0305
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C10H13ClN5O6P
Molecular Weight	365.667
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:08:30 GMT 2025` Edited by `admin` on `Mon Mar 31 18:08:30 GMT 2025`
Record UNII	ACG7003W3B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CLADRIBINE 5'-MONOPHOSPHATE DIAMMONIUM

Common Name

English

2-CHLORO-2'-DEOXY-5'-ADENYLIC ACID DIAMMONIUM

Preferred Name

English

5'-ADENYLIC ACID, 2-CHLORO-2'-DEOXY-, DIAMMONIUM SALT

Systematic Name

English

Code System Code Type Description

FDA UNII

ACG7003W3B

Created by admin on Mon Mar 31 18:08:30 GMT 2025 , Edited by admin on Mon Mar 31 18:08:30 GMT 2025

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CAS

104959-35-5

Created by admin on Mon Mar 31 18:08:30 GMT 2025 , Edited by admin on Mon Mar 31 18:08:30 GMT 2025

PRIMARY

PUBCHEM

88598300

Created by admin on Mon Mar 31 18:08:30 GMT 2025 , Edited by admin on Mon Mar 31 18:08:30 GMT 2025

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CLADRIBINE 5'-MONOPHOSPHATE

PARENT -> SALT/SOLVATE