Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H20N2O3S |
| Molecular Weight | 344.4298 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNCCN1c2ccccc2S[C@@]([H])(c3ccc(cc3)O)[C@]([H])(C1=O)O
InChI
InChIKey=ZTRZZXJIQHVVGS-SJORKVTESA-N
InChI=1S/C18H20N2O3S/c1-19-10-11-20-14-4-2-3-5-15(14)24-17(16(22)18(20)23)12-6-8-13(21)9-7-12/h2-9,16-17,19,21-22H,10-11H2,1H3/t16-,17+/m1/s1
| Molecular Formula | C18H20N2O3S |
| Molecular Weight | 344.4298 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Jun 25 22:30:22 UTC 2021
by
admin
on
Fri Jun 25 22:30:22 UTC 2021
|
| Record UNII |
2JQ1D3G54H
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
2JQ1D3G54H
Created by
admin on Fri Jun 25 22:30:22 UTC 2021 , Edited by admin on Fri Jun 25 22:30:22 UTC 2021
|
PRIMARY | |||
|
86408-42-6
Created by
admin on Fri Jun 25 22:30:22 UTC 2021 , Edited by admin on Fri Jun 25 22:30:22 UTC 2021
|
PRIMARY | |||
|
10472681
Created by
admin on Fri Jun 25 22:30:22 UTC 2021 , Edited by admin on Fri Jun 25 22:30:22 UTC 2021
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MINOR
URINE
|
