Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H20N2O7 |
| Molecular Weight | 412.3927 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]1[C@H](NC(=O)N2C3=CC=CC=C3C=CC4=CC=CC=C24)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O
InChI
InChIKey=VKZWFMGCAPKSML-QXCZDIPSSA-N
InChI=1S/C21H20N2O7/c24-15-16(25)18(20(27)28)30-19(17(15)26)22-21(29)23-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)23/h1-10,15-19,24-26H,(H,22,29)(H,27,28)/t15-,16-,17+,18-,19+/m0/s1
| Molecular Formula | C21H20N2O7 |
| Molecular Weight | 412.3927 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 00:51:48 GMT 2025
by
admin
on
Wed Apr 02 00:51:48 GMT 2025
|
| Record UNII |
FRX2CL2J2P
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
FRX2CL2J2P
Created by
admin on Wed Apr 02 00:51:48 GMT 2025 , Edited by admin on Wed Apr 02 00:51:48 GMT 2025
|
PRIMARY | |||
|
21115954
Created by
admin on Wed Apr 02 00:51:48 GMT 2025 , Edited by admin on Wed Apr 02 00:51:48 GMT 2025
|
PRIMARY | |||
|
DTXSID10975750
Created by
admin on Wed Apr 02 00:51:48 GMT 2025 , Edited by admin on Wed Apr 02 00:51:48 GMT 2025
|
PRIMARY | |||
|
60342-79-2
Created by
admin on Wed Apr 02 00:51:48 GMT 2025 , Edited by admin on Wed Apr 02 00:51:48 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MAJOR
URINE
|