Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C6H9N3O2.3C5H8NO4.C4H6NO4.2Zn.H2O |
| Molecular Weight | 1029.601 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Zn++].[Zn++].N[C@@H](CC([O-])=O)C(O)=O.N[C@@H](CCC([O-])=O)C(O)=O.N[C@@H](CCC([O-])=O)C(O)=O.N[C@@H](CCC([O-])=O)C(O)=O.N[C@@H](CC1=CNC=N1)C(O)=O.N[C@@H](CC2=CNC=N2)C(O)=O
InChI
InChIKey=UMOHHTDIHRJLLE-WOZSYZJWSA-J
InChI=1S/2C6H9N3O2.3C5H9NO4.C4H7NO4.H2O.2Zn/c2*7-5(6(10)11)1-4-2-8-3-9-4;3*6-3(5(9)10)1-2-4(7)8;5-2(4(8)9)1-3(6)7;;;/h2*2-3,5H,1,7H2,(H,8,9)(H,10,11);3*3H,1-2,6H2,(H,7,8)(H,9,10);2H,1,5H2,(H,6,7)(H,8,9);1H2;;/q;;;;;;;2*+2/p-4/t2*5-;3*3-;2-;;;/m000000.../s1
| Molecular Formula | C5H9NO4 |
| Molecular Weight | 147.1293 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | HO |
| Molecular Weight | 17.0073 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C6H9N3O2 |
| Molecular Weight | 155.1546 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C4H5NO4 |
| Molecular Weight | 131.0868 |
| Charge | -2 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:50:13 GMT 2023
by
admin
on
Sat Dec 16 14:50:13 GMT 2023
|
| Record UNII |
B7K315ZJG9
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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B7K315ZJG9
Created by
admin on Sat Dec 16 14:50:13 GMT 2023 , Edited by admin on Sat Dec 16 14:50:13 GMT 2023
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138455008
Created by
admin on Sat Dec 16 14:50:13 GMT 2023 , Edited by admin on Sat Dec 16 14:50:13 GMT 2023
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PRIMARY |