Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H36BrFO6 |
| Molecular Weight | 555.474 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCCC(=O)O[C@@]1([C@@H](C)C[C@H]2[C@@H]3C[C@H](Br)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CO
InChI
InChIKey=XKKFGHDYYAVJSG-MOWALVJDSA-N
InChI=1S/C27H36BrFO6/c1-5-6-7-23(34)35-27(22(33)14-30)15(2)10-17-18-12-20(28)19-11-16(31)8-9-24(19,3)26(18,29)21(32)13-25(17,27)4/h8-9,11,15,17-18,20-21,30,32H,5-7,10,12-14H2,1-4H3/t15-,17-,18-,20-,21-,24-,25-,26-,27-/m0/s1
| Molecular Formula | C27H36BrFO6 |
| Molecular Weight | 555.474 |
| 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
Mon Mar 31 23:42:45 GMT 2025
by
admin
on
Mon Mar 31 23:42:45 GMT 2025
|
| Record UNII |
I3PCK1Z31A
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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162623528
Created by
admin on Mon Mar 31 23:42:45 GMT 2025 , Edited by admin on Mon Mar 31 23:42:45 GMT 2025
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PRIMARY | |||
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I3PCK1Z31A
Created by
admin on Mon Mar 31 23:42:45 GMT 2025 , Edited by admin on Mon Mar 31 23:42:45 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
