Details
Stereochemistry | ACHIRAL |
Molecular Formula | C10H12N2O.C4H7N3O.H2O.H2O4S |
Molecular Weight | 405.427 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.OS(O)(=O)=O.CN1CC(=O)NC1=N.NCCC2=CNC3=C2C=C(O)C=C3
InChI
InChIKey=BKCXVJIGPVULPX-UHFFFAOYSA-N
InChI=1S/C10H12N2O.C4H7N3O.H2O4S.H2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10;1-7-2-3(8)6-4(7)5;1-5(2,3)4;/h1-2,5-6,12-13H,3-4,11H2;2H2,1H3,(H2,5,6,8);(H2,1,2,3,4);1H2
Molecular Formula | H2O4S |
Molecular Weight | 98.078 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C4H7N3O |
Molecular Weight | 113.1179 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C10H12N2O |
Molecular Weight | 176.2151 |
Charge | 0 |
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
Fri Dec 15 15:42:53 UTC 2023
by
admin
on
Fri Dec 15 15:42:53 UTC 2023
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Record UNII |
6L522LAQ9U
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Record Status |
Validated (UNII)
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Record Version |
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-
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61-47-2
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m9871
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admin on Fri Dec 15 15:42:53 UTC 2023 , Edited by admin on Fri Dec 15 15:42:53 UTC 2023
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DTXSID101018936
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300000029178
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164531
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6L522LAQ9U
Created by
admin on Fri Dec 15 15:42:53 UTC 2023 , Edited by admin on Fri Dec 15 15:42:53 UTC 2023
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ACTIVE MOIETY |