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
[H][C@@]12C[C@@H](C)[C@](O)(C(C)=O)[C@@]1(C)C[C@H](O)[C@@]3(Cl)[C@@]2([H])CCC4=CC(=O)C=C[C@]34C
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
Sat Dec 16 18:56:24 UTC 2023
by
admin
on
Sat Dec 16 18:56:24 UTC 2023
|
| Record UNII |
N6DBN42YJR
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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N6DBN42YJR
Created by
admin on Sat Dec 16 18:56:25 UTC 2023 , Edited by admin on Sat Dec 16 18:56:25 UTC 2023
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70476479
Created by
admin on Sat Dec 16 18:56:25 UTC 2023 , Edited by admin on Sat Dec 16 18:56:25 UTC 2023
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57780-86-6
Created by
admin on Sat Dec 16 18:56:25 UTC 2023 , Edited by admin on Sat Dec 16 18:56:25 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
