Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H12N2O3.C7H17NO5 |
| Molecular Weight | 427.4489 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CCN1C=C(C(O)=O)C(=O)C2=C1N=C(C)C=C2
InChI
InChIKey=JWZFGKNDDDVNBX-WZTVWXICSA-N
InChI=1S/C12H12N2O3.C7H17NO5/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14;1-8-2-4(10)6(12)7(13)5(11)3-9/h4-6H,3H2,1-2H3,(H,16,17);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1
| Molecular Formula | C7H17NO5 |
| Molecular Weight | 195.2136 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C12H12N2O3 |
| Molecular Weight | 232.2353 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:27:11 UTC 2023
by
admin
on
Fri Dec 15 17:27:11 UTC 2023
|
| Record UNII |
06F1BL6L7G
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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23277-59-0
Created by
admin on Fri Dec 15 17:27:12 UTC 2023 , Edited by admin on Fri Dec 15 17:27:12 UTC 2023
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PRIMARY | |||
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06F1BL6L7G
Created by
admin on Fri Dec 15 17:27:12 UTC 2023 , Edited by admin on Fri Dec 15 17:27:12 UTC 2023
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PRIMARY | |||
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76972612
Created by
admin on Fri Dec 15 17:27:12 UTC 2023 , Edited by admin on Fri Dec 15 17:27:12 UTC 2023
|
PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |