Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C12H11N2O3.Ca |
| Molecular Weight | 502.533 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CCC1(C(=O)NC(=O)[N-]C1=O)C2=CC=CC=C2.CCC3(C(=O)NC(=O)[N-]C3=O)C4=CC=CC=C4
InChI
InChIKey=ZETGTVOTPNZDKD-UHFFFAOYSA-L
InChI=1S/2C12H12N2O3.Ca/c2*1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16;/h2*3-7H,2H2,1H3,(H2,13,14,15,16,17);/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 | C12H12N2O3 |
| Molecular Weight | 232.2353 |
| 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 16:40:54 UTC 2023
by
admin
on
Fri Dec 15 16:40:54 UTC 2023
|
| Record UNII |
1J4G3UJJ69
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C264
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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NCI_THESAURUS |
C67084
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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1J4G3UJJ69
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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7645-06-9
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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C95059
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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24283
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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SUB03752MIG
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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231-583-1
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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100000085274
Created by
admin on Fri Dec 15 16:40:55 UTC 2023 , Edited by admin on Fri Dec 15 16:40:55 UTC 2023
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PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |