Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C12H14N3O7.Na.2H2O |
Molecular Weight | 371.2758 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.[Na+].O[C@@H](\C=N\NC(=O)C1=CC=NC=C1)[C@@H](O)[C@H](O)[C@H](O)C([O-])=O
InChI
InChIKey=ACIFZFQSDOHAIU-KMDBVMTBSA-M
InChI=1S/C12H15N3O7.Na.2H2O/c16-7(8(17)9(18)10(19)12(21)22)5-14-15-11(20)6-1-3-13-4-2-6;;;/h1-5,7-10,16-19H,(H,15,20)(H,21,22);;2*1H2/q;+1;;/p-1/b14-5+;;;/t7-,8+,9-,10-;;;/m0.../s1
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C12H14N3O7 |
Molecular Weight | 312.2555 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Isoniazid glucuronate is a less toxic derivative the antibacterial drug isoniazid. Isoniazid is recommended for all forms of tuberculosis in which organisms are susceptible. Isoniazid itself is a prodrug and must be activated by bacterial catalase. Isoniazid inhibits InhA, the enoyl reductase from Mycobacterium tuberculosis, by forming a covalent adduct with the NAD cofactor.
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 07:49:11 GMT 2023
by
admin
on
Sat Dec 16 07:49:11 GMT 2023
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Record UNII |
MR1AAS6141
|
Record Status |
Validated (UNII)
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Record Version |
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-
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CHEMBL2110846
Created by
admin on Sat Dec 16 07:49:12 GMT 2023 , Edited by admin on Sat Dec 16 07:49:12 GMT 2023
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53297476
Created by
admin on Sat Dec 16 07:49:12 GMT 2023 , Edited by admin on Sat Dec 16 07:49:12 GMT 2023
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MR1AAS6141
Created by
admin on Sat Dec 16 07:49:12 GMT 2023 , Edited by admin on Sat Dec 16 07:49:12 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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ANHYDROUS->SOLVATE |