Details
Stereochemistry | ACHIRAL |
Molecular Formula | C8H10N5O3.Na.2H2O |
Molecular Weight | 283.217 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.[Na+].NC1=NC2=C(N=CN2COCCO)C(=O)[N-]1
InChI
InChIKey=PGVPRDWPMPODFC-UHFFFAOYSA-M
InChI=1S/C8H11N5O3.Na.2H2O/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14;;;/h3,14H,1-2,4H2,(H3,9,11,12,15);;2*1H2/q;+1;;/p-1
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 | C8H10N5O3 |
Molecular Weight | 224.1967 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:21:03 UTC 2023
by
admin
on
Sat Dec 16 19:21:03 UTC 2023
|
Record UNII |
TZT3J8XU9F
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Record Status |
Validated (UNII)
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Record Version |
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-
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261506-45-0
Created by
admin on Sat Dec 16 19:21:04 UTC 2023 , Edited by admin on Sat Dec 16 19:21:04 UTC 2023
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23676158
Created by
admin on Sat Dec 16 19:21:04 UTC 2023 , Edited by admin on Sat Dec 16 19:21:04 UTC 2023
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TZT3J8XU9F
Created by
admin on Sat Dec 16 19:21:04 UTC 2023 , Edited by admin on Sat Dec 16 19:21:04 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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ANHYDROUS->SOLVATE |
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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