Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H16N4O6.ClH |
| Molecular Weight | 360.75 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[O-][N+](=O)C1=CC=C(O1)\C=N\N2CC(CN3CCOCC3)OC2=O
InChI
InChIKey=PPSVFZXMDMUIGB-FJUODKGNSA-N
InChI=1S/C13H16N4O6.ClH/c18-13-16(14-7-10-1-2-12(22-10)17(19)20)9-11(23-13)8-15-3-5-21-6-4-15;/h1-2,7,11H,3-6,8-9H2;1H/b14-7+;
| Molecular Formula | C13H16N4O6 |
| Molecular Weight | 324.2893 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Optical Activity | ( + / - ) |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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 16:39:31 UTC 2023
by
admin
on
Fri Dec 15 16:39:31 UTC 2023
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| Record UNII |
37Q02H7JT2
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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9576185
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37Q02H7JT2
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223-169-4
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SUB02285MIG
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DTXSID5045380
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100000087020
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3759-92-0
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53270
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admin on Fri Dec 15 16:39:31 UTC 2023 , Edited by admin on Fri Dec 15 16:39:31 UTC 2023
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| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |