Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C8H11NO.C4H6O5 |
| Molecular Weight | 271.2665 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(CC(O)=O)C(O)=O.CCC1=NC(C)=CC=C1O
InChI
InChIKey=NUJVRSXTGYOYFY-UHFFFAOYSA-N
InChI=1S/C8H11NO.C4H6O5/c1-3-7-8(10)5-4-6(2)9-7;5-2(4(8)9)1-3(6)7/h4-5,10H,3H2,1-2H3;2,5H,1H2,(H,6,7)(H,8,9)
| Molecular Formula | C8H11NO |
| Molecular Weight | 137.179 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C4H6O5 |
| Molecular Weight | 134.0874 |
| Charge | 0 |
| 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
Sat Dec 16 17:11:27 UTC 2023
by
admin
on
Sat Dec 16 17:11:27 UTC 2023
|
| Record UNII |
V99Y17D9FK
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
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| Code System | Code | Type | Description | ||
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1202186-30-8
Created by
admin on Sat Dec 16 17:11:28 UTC 2023 , Edited by admin on Sat Dec 16 17:11:28 UTC 2023
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PRIMARY | |||
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71487940
Created by
admin on Sat Dec 16 17:11:28 UTC 2023 , Edited by admin on Sat Dec 16 17:11:28 UTC 2023
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PRIMARY | |||
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V99Y17D9FK
Created by
admin on Sat Dec 16 17:11:28 UTC 2023 , Edited by admin on Sat Dec 16 17:11:28 UTC 2023
|
PRIMARY |
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|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |