Details
Stereochemistry | ACHIRAL |
Molecular Formula | C11H14N2S.C6H8O7 |
Molecular Weight | 398.431 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1CCCN=C1\C=C\C2=CC=CS2
InChI
InChIKey=YJGGCARNRYGSPA-IPZCTEOASA-N
InChI=1S/C11H14N2S.C6H8O7/c1-13-8-3-7-12-11(13)6-5-10-4-2-9-14-10;7-3(8)1-6(13,5(11)12)2-4(9)10/h2,4-6,9H,3,7-8H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b6-5+;
Molecular Formula | C11H14N2S |
Molecular Weight | 206.307 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
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
Fri Dec 15 19:45:22 GMT 2023
by
admin
on
Fri Dec 15 19:45:22 GMT 2023
|
Record UNII |
1YXE665Z2S
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
6436405
Created by
admin on Fri Dec 15 19:45:22 GMT 2023 , Edited by admin on Fri Dec 15 19:45:22 GMT 2023
|
PRIMARY | |||
|
DBSALT002662
Created by
admin on Fri Dec 15 19:45:22 GMT 2023 , Edited by admin on Fri Dec 15 19:45:22 GMT 2023
|
PRIMARY | |||
|
DTXSID401034016
Created by
admin on Fri Dec 15 19:45:22 GMT 2023 , Edited by admin on Fri Dec 15 19:45:22 GMT 2023
|
PRIMARY | |||
|
1YXE665Z2S
Created by
admin on Fri Dec 15 19:45:22 GMT 2023 , Edited by admin on Fri Dec 15 19:45:22 GMT 2023
|
PRIMARY | |||
|
227-154-3
Created by
admin on Fri Dec 15 19:45:22 GMT 2023 , Edited by admin on Fri Dec 15 19:45:22 GMT 2023
|
PRIMARY | |||
|
5685-86-9
Created by
admin on Fri Dec 15 19:45:22 GMT 2023 , Edited by admin on Fri Dec 15 19:45:22 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> SALT/SOLVATE | |||
|
PARENT -> SALT/SOLVATE |