Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 3C6H8N3O2.C3H6NO2S.Zn.2H |
Molecular Weight | 650.015 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H+].[H+].[Zn++].N[C@@H](C[S-])C(O)=O.N[C@@H](CC1=C[N-]C=N1)C(O)=O.N[C@@H](CC2=C[N-]C=N2)C(O)=O.N[C@@H](CC3=C[N-]C=N3)C(O)=O
InChI
InChIKey=HWGXIDYUXOKNDC-CEMNOOQYSA-L
InChI=1S/3C6H9N3O2.C3H7NO2S.Zn/c3*7-5(6(10)11)1-4-2-8-3-9-4;4-2(1-7)3(5)6;/h3*2-3,5H,1,7H2,(H2,8,9,10,11);2,7H,1,4H2,(H,5,6);/q;;;;+2/p-2/t3*5-;2-;/m0000./s1
Molecular Formula | Zn |
Molecular Weight | 65.409 |
Charge | 2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | H |
Molecular Weight | 1.0079 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C3H6NO2S |
Molecular Weight | 120.15 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C6H8N3O2 |
Molecular Weight | 154.1466 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:18:13 GMT 2023
by
admin
on
Sat Dec 16 15:18:13 GMT 2023
|
Record UNII |
0RK9393AEN
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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0RK9393AEN
Created by
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139593542
Created by
admin on Sat Dec 16 15:18:13 GMT 2023 , Edited by admin on Sat Dec 16 15:18:13 GMT 2023
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