Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H29ClO4 |
| Molecular Weight | 392.916 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@@]1(O)C(C)=O
InChI
InChIKey=PPHLHSSXDSBOAQ-QAHQDLQKSA-N
InChI=1S/C22H29ClO4/c1-12-9-17-16-6-5-14-10-15(25)7-8-19(14,3)21(16,23)18(26)11-20(17,4)22(12,27)13(2)24/h7-8,10,12,16-18,26-27H,5-6,9,11H2,1-4H3/t12-,16+,17+,18+,19+,20+,21+,22+/m1/s1
| Molecular Formula | C22H29ClO4 |
| Molecular Weight | 392.916 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 12:51:17 GMT 2025
by
admin
on
Wed Apr 02 12:51:17 GMT 2025
|
| Record UNII |
N6DBN42YJR
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
N6DBN42YJR
Created by
admin on Wed Apr 02 12:51:17 GMT 2025 , Edited by admin on Wed Apr 02 12:51:17 GMT 2025
|
PRIMARY | |||
|
70476479
Created by
admin on Wed Apr 02 12:51:17 GMT 2025 , Edited by admin on Wed Apr 02 12:51:17 GMT 2025
|
PRIMARY | |||
|
57780-86-6
Created by
admin on Wed Apr 02 12:51:17 GMT 2025 , Edited by admin on Wed Apr 02 12:51:17 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|