Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C8H8O5 |
| Molecular Weight | 184.1461 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@@H](C(O)=O)C1=CC(O)=C(O)C=C1
InChI
InChIKey=RGHMISIYKIHAJW-SSDOTTSWSA-N
InChI=1S/C8H8O5/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,9-11H,(H,12,13)/t7-/m1/s1
| Molecular Formula | C8H8O5 |
| Molecular Weight | 184.1461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:05:49 GMT 2023
by
admin
on
Sat Dec 16 08:05:49 GMT 2023
|
| Record UNII |
M8Q69OD5W1
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
M8Q69OD5W1
Created by
admin on Sat Dec 16 08:05:49 GMT 2023 , Edited by admin on Sat Dec 16 08:05:49 GMT 2023
|
PRIMARY | |||
|
6950181
Created by
admin on Sat Dec 16 08:05:49 GMT 2023 , Edited by admin on Sat Dec 16 08:05:49 GMT 2023
|
PRIMARY | |||
|
64998-15-8
Created by
admin on Sat Dec 16 08:05:49 GMT 2023 , Edited by admin on Sat Dec 16 08:05:49 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
RACEMATE -> ENANTIOMER |
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
|
||
|
PARENT -> METABOLITE INACTIVE |
Unit: percent of tritium in the urine;
See table 1 in the source document.
IN-VIVO
URINE
|
