Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C15H21N3O.C6H8O7 |
| Molecular Weight | 451.4703 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CN(C)CCO[C@@H](C1=CC=NN1C)C2=CC=CC=C2
InChI
InChIKey=JLKUMSHHQYQLSG-XFULWGLBSA-N
InChI=1S/C15H21N3O.C6H8O7/c1-17(2)11-12-19-15(13-7-5-4-6-8-13)14-9-10-16-18(14)3;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-10,15H,11-12H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t15-;/m1./s1
| Molecular Formula | C15H21N3O |
| Molecular Weight | 259.3467 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C6H8O7 |
| Molecular Weight | 192.1235 |
| 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
Mon Mar 31 23:43:23 GMT 2025
by
admin
on
Mon Mar 31 23:43:23 GMT 2025
|
| Record UNII |
X46HGD2GYX
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Systematic Name | English |
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10114897
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148981-63-9
Created by
admin on Mon Mar 31 23:43:23 GMT 2025 , Edited by admin on Mon Mar 31 23:43:23 GMT 2025
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X46HGD2GYX
Created by
admin on Mon Mar 31 23:43:23 GMT 2025 , Edited by admin on Mon Mar 31 23:43:23 GMT 2025
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PRIMARY |