Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C21H29N5O2.C2H2O4 |
| Molecular Weight | 473.5221 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.COCCCN1CCC(CC1)C2=NN=C(O2)C3=NN(C(C)C)C4=C3C=CC=C4
InChI
InChIKey=XHXCJKNEBFAUSE-UHFFFAOYSA-N
InChI=1S/C21H29N5O2.C2H2O4/c1-15(2)26-18-8-5-4-7-17(18)19(24-26)21-23-22-20(28-21)16-9-12-25(13-10-16)11-6-14-27-3;3-1(4)2(5)6/h4-5,7-8,15-16H,6,9-14H2,1-3H3;(H,3,4)(H,5,6)
| Molecular Formula | C21H29N5O2 |
| Molecular Weight | 383.4873 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C2H2O4 |
| Molecular Weight | 90.0349 |
| 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
Tue Apr 01 19:51:23 GMT 2025
by
admin
on
Tue Apr 01 19:51:23 GMT 2025
|
| Record UNII |
1JPX7J35CG
|
| Record Status |
Validated (UNII)
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| Record Version |
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1JPX7J35CG
Created by
admin on Tue Apr 01 19:51:23 GMT 2025 , Edited by admin on Tue Apr 01 19:51:23 GMT 2025
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71508290
Created by
admin on Tue Apr 01 19:51:23 GMT 2025 , Edited by admin on Tue Apr 01 19:51:23 GMT 2025
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1428862-33-2
Created by
admin on Tue Apr 01 19:51:23 GMT 2025 , Edited by admin on Tue Apr 01 19:51:23 GMT 2025
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PRIMARY |
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