Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C11H12NO3.Na |
| Molecular Weight | 229.2076 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC(=O)N[C@H](CC1=CC=CC=C1)C([O-])=O
InChI
InChIKey=RBMBEFVVHHNLAR-HNCPQSOCSA-M
InChI=1S/C11H13NO3.Na/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9;/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15);/q;+1/p-1/t10-;/m1./s1
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C11H12NO3 |
| Molecular Weight | 206.2179 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:35:22 GMT 2023
by
admin
on
Sat Dec 16 09:35:22 GMT 2023
|
| Record UNII |
529A9K9653
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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91800017
Created by
admin on Sat Dec 16 09:35:22 GMT 2023 , Edited by admin on Sat Dec 16 09:35:22 GMT 2023
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79634-18-7
Created by
admin on Sat Dec 16 09:35:22 GMT 2023 , Edited by admin on Sat Dec 16 09:35:22 GMT 2023
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529A9K9653
Created by
admin on Sat Dec 16 09:35:22 GMT 2023 , Edited by admin on Sat Dec 16 09:35:22 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
