Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H28Cl2O7 |
| Molecular Weight | 535.413 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12C[C@@H](C)[C@](OC(=O)C3=CC=CO3)(C(=O)CCl)[C@@]1(C)C[C@H](O)[C@@]4(Cl)[C@@]2([H])CC(=O)C5=CC(=O)C=C[C@]45C
InChI
InChIKey=XXMUYUVNHWPWLS-KORTYEGJSA-N
InChI=1S/C27H28Cl2O7/c1-14-9-16-17-11-19(31)18-10-15(30)6-7-24(18,2)26(17,29)21(32)12-25(16,3)27(14,22(33)13-28)36-23(34)20-5-4-8-35-20/h4-8,10,14,16-17,21,32H,9,11-13H2,1-3H3/t14-,16+,17+,21+,24+,25+,26+,27+/m1/s1
| Molecular Formula | C27H28Cl2O7 |
| Molecular Weight | 535.413 |
| 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 18:39:08 UTC 2023
by
admin
on
Sat Dec 16 18:39:08 UTC 2023
|
| Record UNII |
HQ9B6K29E6
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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1305334-30-8
Created by
admin on Sat Dec 16 18:39:09 UTC 2023 , Edited by admin on Sat Dec 16 18:39:09 UTC 2023
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129011919
Created by
admin on Sat Dec 16 18:39:09 UTC 2023 , Edited by admin on Sat Dec 16 18:39:09 UTC 2023
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HQ9B6K29E6
Created by
admin on Sat Dec 16 18:39:09 UTC 2023 , Edited by admin on Sat Dec 16 18:39:09 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
