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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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
YU77Z3NY6Z
Record Status Validated (UNII)
Record Version