Details
| Stereochemistry | RACEMIC |
| Molecular Formula | 2C15H12NO3.Ca |
| Molecular Weight | 548.599 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].[O-]C(=O)C1CCN2C1=CC=C2C(=O)C3=CC=CC=C3.[O-]C(=O)C4CCN5C4=CC=C5C(=O)C6=CC=CC=C6
InChI
InChIKey=NPCGTDZMTWNBDA-UHFFFAOYSA-L
InChI=1S/2C15H13NO3.Ca/c2*17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13;/h2*1-7,11H,8-9H2,(H,18,19);/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 | C15H12NO3 |
| Molecular Weight | 254.2607 |
| Charge | -1 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:05:43 GMT 2025
by
admin
on
Mon Mar 31 18:05:43 GMT 2025
|
| Record UNII |
52541KD36N
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
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52541KD36N
Created by
admin on Mon Mar 31 18:05:43 GMT 2025 , Edited by admin on Mon Mar 31 18:05:43 GMT 2025
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167105-81-9
Created by
admin on Mon Mar 31 18:05:43 GMT 2025 , Edited by admin on Mon Mar 31 18:05:43 GMT 2025
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71587565
Created by
admin on Mon Mar 31 18:05:43 GMT 2025 , Edited by admin on Mon Mar 31 18:05:43 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |