Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C13H12O8 |
| Molecular Weight | 296.2296 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(OC(=O)\C=C\C1=CC=C(O)C(O)=C1)C(O)=O
InChI
InChIKey=PMKQSEYPLQIEAY-DUXPYHPUSA-N
InChI=1S/C13H12O8/c14-8-3-1-7(5-9(8)15)2-4-12(18)21-10(13(19)20)6-11(16)17/h1-5,10,14-15H,6H2,(H,16,17)(H,19,20)/b4-2+
| Molecular Formula | C13H12O8 |
| Molecular Weight | 296.2296 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 09:54:32 GMT 2025
by
admin
on
Wed Apr 02 09:54:32 GMT 2025
|
| Record UNII |
8EY7S5QS7D
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Common Name | English | ||
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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Caffeoylmalic acid
Created by
admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025
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PRIMARY | |||
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8EY7S5QS7D
Created by
admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025
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PRIMARY | |||
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39015-77-5
Created by
admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025
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NON-SPECIFIC STEREOCHEMISTRY | |||
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92344-57-5
Created by
admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025
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PRIMARY | |||
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90471964
Created by
admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> RACEMATE |
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ENANTIOMER -> RACEMATE |
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