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Details

Stereochemistry ACHIRAL
Molecular Formula C5H5N5.H3O4P
Molecular Weight 233.1219
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADENINE PHOSPHATE

SMILES

OP(O)(O)=O.NC1=C2N=CNC2=NC=N1

InChI

InChIKey=CCHNOBQMQBSRHQ-UHFFFAOYSA-N
InChI=1S/C5H5N5.H3O4P/c6-4-3-5(9-1-7-3)10-2-8-4;1-5(2,3)4/h1-2H,(H3,6,7,8,9,10);(H3,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula C5H5N5
Molecular Weight 135.1267
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H3O4P
Molecular Weight 97.9952
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:02:08 UTC 2023
Edited
by admin
on Sat Dec 16 18:02:08 UTC 2023
Record UNII
RUT8S5GS8Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADENINE PHOSPHATE
Common Name English
ADENINE PHOSPHATE SALT
Common Name English
Adenine phosphate [WHO-DD]
Common Name English
1H-PURIN-6-AMINE, PHOSPHATE (1:1)
Systematic Name English
Code System Code Type Description
SMS_ID
100000086053
Created by admin on Sat Dec 16 18:02:09 UTC 2023 , Edited by admin on Sat Dec 16 18:02:09 UTC 2023
PRIMARY
CAS
70700-30-0
Created by admin on Sat Dec 16 18:02:09 UTC 2023 , Edited by admin on Sat Dec 16 18:02:09 UTC 2023
PRIMARY
FDA UNII
RUT8S5GS8Z
Created by admin on Sat Dec 16 18:02:09 UTC 2023 , Edited by admin on Sat Dec 16 18:02:09 UTC 2023
PRIMARY
PUBCHEM
198277
Created by admin on Sat Dec 16 18:02:09 UTC 2023 , Edited by admin on Sat Dec 16 18:02:09 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY