Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H16N2O2.C4H6O6 |
| Molecular Weight | 382.3652 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CC[C@]1(CCC(=O)NC1=O)C2=CC=C(N)C=C2
InChI
InChIKey=DQUXPVVSVXIQNE-TZXXFBNGSA-N
InChI=1S/C13H16N2O2.C4H6O6/c1-2-13(8-7-11(16)15-12(13)17)9-3-5-10(14)6-4-9;5-1(3(7)8)2(6)4(9)10/h3-6H,2,7-8,14H2,1H3,(H,15,16,17);1-2,5-6H,(H,7,8)(H,9,10)/t13-;1-,2-/m01/s1
| Molecular Formula | C13H16N2O2 |
| Molecular Weight | 232.2783 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C4H6O6 |
| Molecular Weight | 150.0868 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:20:05 GMT 2023
by
admin
on
Fri Dec 15 15:20:05 GMT 2023
|
| Record UNII |
625K4DEO0G
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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90479474
Created by
admin on Fri Dec 15 15:20:05 GMT 2023 , Edited by admin on Fri Dec 15 15:20:05 GMT 2023
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PRIMARY | |||
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62268-19-3
Created by
admin on Fri Dec 15 15:20:05 GMT 2023 , Edited by admin on Fri Dec 15 15:20:05 GMT 2023
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PRIMARY | |||
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625K4DEO0G
Created by
admin on Fri Dec 15 15:20:05 GMT 2023 , Edited by admin on Fri Dec 15 15:20:05 GMT 2023
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PRIMARY |