U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H17N7O8S
Molecular Weight 395.349
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GONYAUTOXIN II

SMILES

[H][C@@]12NC(=N)N[C@]13N(C[C@@H](OS(O)(=O)=O)C3(O)O)C(=N)N[C@H]2COC(N)=O

InChI

InChIKey=ARSXTTJGWGCRRR-XXKOCQOQSA-N
InChI=1S/C10H17N7O8S/c11-6-15-5-3(2-24-8(13)18)14-7(12)17-1-4(25-26(21,22)23)10(19,20)9(5,17)16-6/h3-5,19-20H,1-2H2,(H2,12,14)(H2,13,18)(H3,11,15,16)(H,21,22,23)/t3-,4+,5-,9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H17N7O8S
Molecular Weight 395.349
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:07:38 GMT 2023
Edited
by admin
on Sat Dec 16 10:07:38 GMT 2023
Record UNII
YU77Z3NY6Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GONYAUTOXIN II
Common Name English
GTX II
Common Name English
GONYAUTOXIN IIM
Common Name English
1H,10H-PYRROLO(1,2-C)PURINE-9,10,10-TRIOL, 2,6-DIAMINO-4-(((AMINOCARBONYL)OXY)METHYL)-3A,4,8,9-TETRAHYDRO-, 9-(HYDROGEN SULFATE), (3AS-(3A.ALPHA.,4.ALPHA.,9.BETA.,10AR*))- 11.ALPHA.-HYDROXYSAXITOXIN 11-SULFATE
Systematic Name English
GONYAUTOXIN 2
Common Name English
GTX2
Common Name English
Code System Code Type Description
CAS
60508-89-6
Created by admin on Sat Dec 16 10:07:38 GMT 2023 , Edited by admin on Sat Dec 16 10:07:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID90880095
Created by admin on Sat Dec 16 10:07:38 GMT 2023 , Edited by admin on Sat Dec 16 10:07:38 GMT 2023
PRIMARY
FDA UNII
YU77Z3NY6Z
Created by admin on Sat Dec 16 10:07:38 GMT 2023 , Edited by admin on Sat Dec 16 10:07:38 GMT 2023
PRIMARY
PUBCHEM
101650338
Created by admin on Sat Dec 16 10:07:38 GMT 2023 , Edited by admin on Sat Dec 16 10:07:38 GMT 2023
PRIMARY