Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C7H8N4O2.C7H4O3.Ca |
| Molecular Weight | 356.347 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].[O-]C(=O)C1=CC=CC=C1[O-].CN2C=NC3=C2C(=O)NC(=O)N3C
InChI
InChIKey=UFGVUHDWEQMLGF-UHFFFAOYSA-L
InChI=1S/C7H8N4O2.C7H6O3.Ca/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2;8-6-4-2-1-3-5(6)7(9)10;/h3H,1-2H3,(H,9,12,13);1-4,8H,(H,9,10);/q;;+2/p-2
| Molecular Formula | Ca |
| Molecular Weight | 40.078 |
| Charge | 2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C7H8N4O2 |
| Molecular Weight | 180.164 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C7H4O3 |
| Molecular Weight | 136.1049 |
| 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
Fri Dec 15 15:48:59 UTC 2023
by
admin
on
Fri Dec 15 15:48:59 UTC 2023
|
| Record UNII |
N5ZZ1LY24G
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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70691444
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8065-51-8
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100000076966
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m10703
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admin on Fri Dec 15 15:48:59 UTC 2023 , Edited by admin on Fri Dec 15 15:48:59 UTC 2023
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PRIMARY | Merck Index | ||
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N5ZZ1LY24G
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CHEMBL1114
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SUB15512MIG
Created by
admin on Fri Dec 15 15:48:59 UTC 2023 , Edited by admin on Fri Dec 15 15:48:59 UTC 2023
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ACTIVE MOIETY |