Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H26FNO3 |
| Molecular Weight | 431.4986 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C1=NC(=CC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H]3C[C@@H](O)CC(=O)O3)C4=CC=CC=C4
InChI
InChIKey=LJIZUXQINHXGAO-ITWZMISCSA-N
InChI=1S/C27H26FNO3/c1-17(2)27-23(13-12-22-14-21(30)15-26(31)32-22)24(18-8-10-20(28)11-9-18)16-25(29-27)19-6-4-3-5-7-19/h3-13,16-17,21-22,30H,14-15H2,1-2H3/b13-12+/t21-,22-/m1/s1
| Molecular Formula | C27H26FNO3 |
| Molecular Weight | 431.4986 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:27:46 UTC 2023
by
admin
on
Fri Dec 15 16:27:46 UTC 2023
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| Record UNII |
X98U22RT62
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1655
Created by
admin on Fri Dec 15 16:27:46 UTC 2023 , Edited by admin on Fri Dec 15 16:27:46 UTC 2023
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CHEMBL2106777
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C73064
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7199
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122254-45-9
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100000080421
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SUB07913MIG
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5281970
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DTXSID60100944
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X98U22RT62
Created by
admin on Fri Dec 15 16:27:46 UTC 2023 , Edited by admin on Fri Dec 15 16:27:46 UTC 2023
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