Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H19N3OS.C6H8O7 |
| Molecular Weight | 505.541 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.C1[C@H]2C[C@@H]3CN(C2)C[C@H]1[C@@H]3OC4=NN=C(S4)C5=CC=CC=C5
InChI
InChIKey=JIGJENFBLHIYGW-NOMIPIDJSA-N
InChI=1S/C17H19N3OS.C6H8O7/c1-2-4-12(5-3-1)16-18-19-17(22-16)21-15-13-6-11-7-14(15)10-20(8-11)9-13;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-5,11,13-15H,6-10H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t11-,13-,14+,15-;
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Preferred Name | English | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English | ||
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Common Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
78425850
Created by
admin on Mon Mar 31 20:39:54 GMT 2025 , Edited by admin on Mon Mar 31 20:39:54 GMT 2025
|
PRIMARY | |||
|
1627957-66-7
Created by
admin on Mon Mar 31 20:39:54 GMT 2025 , Edited by admin on Mon Mar 31 20:39:54 GMT 2025
|
NON-SPECIFIC STEREOCHEMISTRY | |||
|
5SJ035Q1BQ
Created by
admin on Mon Mar 31 20:39:54 GMT 2025 , Edited by admin on Mon Mar 31 20:39:54 GMT 2025
|
PRIMARY | |||
|
1026136-84-4
Created by
admin on Mon Mar 31 20:39:54 GMT 2025 , Edited by admin on Mon Mar 31 20:39:54 GMT 2025
|
PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
