Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C5H6NO3.Ca |
Molecular Weight | 296.29 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].[O-]C(=O)[C@@H]1CCC(=O)N1.[O-]C(=O)[C@@H]2CCC(=O)N2
InChI
InChIKey=YQFZERWESBDNRJ-QHTZZOMLSA-L
InChI=1S/2C5H7NO3.Ca/c2*7-4-2-1-3(6-4)5(8)9;/h2*3H,1-2H2,(H,6,7)(H,8,9);/q;;+2/p-2/t2*3-;/m00./s1
Molecular Formula | C5H6NO3 |
Molecular Weight | 128.106 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:38:49 UTC 2023
by
admin
on
Fri Dec 15 15:38:49 UTC 2023
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Record UNII |
7Y2LVU5EKK
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Record Status |
Validated (UNII)
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Record Version |
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-
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87393
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7Y2LVU5EKK
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7Y2LVU5EKK
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DTXSID501019893
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100000090379
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C092985
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250-602-4
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31377-05-6
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14559044
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SUB13194MIG
Created by
admin on Fri Dec 15 15:38:49 UTC 2023 , Edited by admin on Fri Dec 15 15:38:49 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |