Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C10H12N2O.C4H6O6 |
| Molecular Weight | 326.3019 |
| 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.CN1[C@@H](CCC1=O)C2=CN=CC=C2
InChI
InChIKey=NNGHNRKZQZZELM-NDAAPVSOSA-N
InChI=1S/C10H12N2O.C4H6O6/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8;5-1(3(7)8)2(6)4(9)10/h2-3,6-7,9H,4-5H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t9-;1-,2-/m01/s1
| 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 |
| Molecular Formula | C10H12N2O |
| Molecular Weight | 176.2151 |
| Charge | 0 |
| 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
Fri Dec 15 15:50:50 UTC 2023
by
admin
on
Fri Dec 15 15:50:50 UTC 2023
|
| Record UNII |
FQ7X51Z02G
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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4315-41-7
Created by
admin on Fri Dec 15 15:50:50 UTC 2023 , Edited by admin on Fri Dec 15 15:50:50 UTC 2023
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FQ7X51Z02G
Created by
admin on Fri Dec 15 15:50:50 UTC 2023 , Edited by admin on Fri Dec 15 15:50:50 UTC 2023
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91826822
Created by
admin on Fri Dec 15 15:50:50 UTC 2023 , Edited by admin on Fri Dec 15 15:50:50 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |