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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19N7O7S
Molecular Weight 417.398
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DB-03376

SMILES

C[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=NC3=C2N=CN=C3N

InChI

InChIKey=CWWYMWDIYBJVLP-YTMOPEAISA-N
InChI=1S/C13H19N7O7S/c1-5(14)12(23)19-28(24,25)26-2-6-8(21)9(22)13(27-6)20-4-18-7-10(15)16-3-17-11(7)20/h3-6,8-9,13,21-22H,2,14H2,1H3,(H,19,23)(H2,15,16,17)/t5-,6+,8+,9+,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H19N7O7S
Molecular Weight 417.398
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:51:02 UTC 2023
Edited
by admin
on Sat Dec 16 11:51:02 UTC 2023
Record UNII
48GG0U2X78
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DB-03376
Common Name English
ADENOSINE, 5'-(((2S)-2-AMINO-1-OXOPROPYL)SULFAMATE)
Systematic Name English
5'-O-(N-(L-ALANYL)-SULFAMOYL)ADENOSINE
Systematic Name English
ADENOSINE, 5'-(N-((2S)-2-AMINO-1-OXOPROPYL)SULFAMATE)
Systematic Name English
Code System Code Type Description
CAS
112921-04-7
Created by admin on Sat Dec 16 11:51:02 UTC 2023 , Edited by admin on Sat Dec 16 11:51:02 UTC 2023
PRIMARY
DRUG BANK
DB03376
Created by admin on Sat Dec 16 11:51:02 UTC 2023 , Edited by admin on Sat Dec 16 11:51:02 UTC 2023
PRIMARY
FDA UNII
48GG0U2X78
Created by admin on Sat Dec 16 11:51:02 UTC 2023 , Edited by admin on Sat Dec 16 11:51:02 UTC 2023
PRIMARY
EPA CompTox
DTXSID60920952
Created by admin on Sat Dec 16 11:51:02 UTC 2023 , Edited by admin on Sat Dec 16 11:51:02 UTC 2023
PRIMARY
PUBCHEM
196672
Created by admin on Sat Dec 16 11:51:02 UTC 2023 , Edited by admin on Sat Dec 16 11:51:02 UTC 2023
PRIMARY