Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C22H31NO2.C6H8O7 |
| Molecular Weight | 533.6106 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CCN(CC)CCOC1=CC=C(C=C1)C(C)CC2=CC=C(OC)C=C2
InChI
InChIKey=JXWBFODZYRPZEU-UHFFFAOYSA-N
InChI=1S/C22H31NO2.C6H8O7/c1-5-23(6-2)15-16-25-22-13-9-20(10-14-22)18(3)17-19-7-11-21(24-4)12-8-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-14,18H,5-6,15-17H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
| Molecular Formula | C22H31NO2 |
| Molecular Weight | 341.487 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| 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
Mon Mar 31 22:13:23 GMT 2025
by
admin
on
Mon Mar 31 22:13:23 GMT 2025
|
| Record UNII |
UDS6874TZG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
15624-34-7
Created by
admin on Mon Mar 31 22:13:23 GMT 2025 , Edited by admin on Mon Mar 31 22:13:23 GMT 2025
|
PRIMARY | |||
|
204120
Created by
admin on Mon Mar 31 22:13:23 GMT 2025 , Edited by admin on Mon Mar 31 22:13:23 GMT 2025
|
PRIMARY | |||
|
UDS6874TZG
Created by
admin on Mon Mar 31 22:13:23 GMT 2025 , Edited by admin on Mon Mar 31 22:13:23 GMT 2025
|
PRIMARY | |||
|
DTXSID70935411
Created by
admin on Mon Mar 31 22:13:23 GMT 2025 , Edited by admin on Mon Mar 31 22:13:23 GMT 2025
|
PRIMARY |