Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C28H36BrClO7 |
| Molecular Weight | 599.938 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12C[C@H](C)[C@](OC(=O)CC)(C(=O)COC(=O)CC)[C@@]1(C)C[C@H](O)[C@@]3(Cl)[C@@]2([H])C[C@H](Br)C4=CC(=O)C=C[C@]34C
InChI
InChIKey=BSGQBFGKJSUQPK-DXABFYDXSA-N
InChI=1S/C28H36BrClO7/c1-6-23(34)36-14-22(33)28(37-24(35)7-2)15(3)10-17-18-12-20(29)19-11-16(31)8-9-25(19,4)27(18,30)21(32)13-26(17,28)5/h8-9,11,15,17-18,20-21,32H,6-7,10,12-14H2,1-5H3/t15-,17-,18-,20-,21-,25-,26-,27-,28-/m0/s1
| Molecular Formula | C28H36BrClO7 |
| Molecular Weight | 599.938 |
| 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 08:57:16 GMT 2023
by
admin
on
Sat Dec 16 08:57:16 GMT 2023
|
| Record UNII |
BL5X7EQH6W
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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DTXSID50747216
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887130-69-0
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71314215
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admin on Sat Dec 16 08:57:16 GMT 2023 , Edited by admin on Sat Dec 16 08:57:16 GMT 2023
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BL5X7EQH6W
Created by
admin on Sat Dec 16 08:57:16 GMT 2023 , Edited by admin on Sat Dec 16 08:57:16 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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