Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H16N4O9S |
| Molecular Weight | 392.342 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(=O)(=O)OCCNC1=C(C=C(C=C1C(=O)NCCO)[N+]([O-])=O)[N+]([O-])=O
InChI
InChIKey=FLBSKIPLSNJURB-UHFFFAOYSA-N
InChI=1S/C12H16N4O9S/c1-26(23,24)25-5-3-13-11-9(12(18)14-2-4-17)6-8(15(19)20)7-10(11)16(21)22/h6-7,13,17H,2-5H2,1H3,(H,14,18)
| Molecular Formula | C12H16N4O9S |
| Molecular Weight | 392.342 |
| 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
Sat Dec 16 16:36:14 GMT 2023
by
admin
on
Sat Dec 16 16:36:14 GMT 2023
|
| Record UNII |
XW9HP2G9ED
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
44596205
Created by
admin on Sat Dec 16 16:36:14 GMT 2023 , Edited by admin on Sat Dec 16 16:36:14 GMT 2023
|
PRIMARY | |||
|
1178568-89-2
Created by
admin on Sat Dec 16 16:36:14 GMT 2023 , Edited by admin on Sat Dec 16 16:36:14 GMT 2023
|
PRIMARY | |||
|
XW9HP2G9ED
Created by
admin on Sat Dec 16 16:36:14 GMT 2023 , Edited by admin on Sat Dec 16 16:36:14 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
PLASMA; URINE
|
||
|
PARENT -> METABOLITE |
PLASMA; URINE
|
