Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C24H30F2O6.2H2O |
| Molecular Weight | 488.5188 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.[H][C@@]12C[C@H]3OC(C)(C)O[C@@]3(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])C[C@H](F)C5=CC(=O)C=C[C@]45C
InChI
InChIKey=IZAKVVPJGZHECV-UPXIRYIGSA-N
InChI=1S/C24H30F2O6.2H2O/c1-20(2)31-19-9-13-14-8-16(25)15-7-12(28)5-6-21(15,3)23(14,26)17(29)10-22(13,4)24(19,32-20)18(30)11-27;;/h5-7,13-14,16-17,19,27,29H,8-11H2,1-4H3;2*1H2/t13-,14-,16-,17-,19+,21-,22-,23-,24+;;/m0../s1
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C24H30F2O6 |
| Molecular Weight | 452.4882 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:02:40 UTC 2023
by
admin
on
Sat Dec 16 01:02:40 UTC 2023
|
| Record UNII |
85JNE553V5
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English |
| Code System | Code | Type | Description | ||
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85JNE553V5
Created by
admin on Sat Dec 16 01:02:40 UTC 2023 , Edited by admin on Sat Dec 16 01:02:40 UTC 2023
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PRIMARY | |||
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76959717
Created by
admin on Sat Dec 16 01:02:40 UTC 2023 , Edited by admin on Sat Dec 16 01:02:40 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
