Details
Stereochemistry | EPIMERIC |
Molecular Formula | C38H44F2N6O11 |
Molecular Weight | 798.7864 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)C1=NC2=C(C=CC=C2)C=C1)C(C)C)C(=O)N[C@@H](C)C(=O)NC(CC(O)=O)C(=O)COC3=C(F)C=CC=C3F
InChI
InChIKey=ZLCLJYNODFKEEJ-XPPVUYTGSA-N
InChI=1S/C38H44F2N6O11/c1-18(2)31(37(55)41-20(5)34(52)43-26(15-29(48)49)28(47)17-57-33-22(39)10-8-11-23(33)40)46-36(54)27(16-30(50)51)44-38(56)32(19(3)4)45-35(53)25-14-13-21-9-6-7-12-24(21)42-25/h6-14,18-20,26-27,31-32H,15-17H2,1-5H3,(H,41,55)(H,43,52)(H,44,56)(H,45,53)(H,46,54)(H,48,49)(H,50,51)/t20-,26?,27-,31-,32-/m0/s1
Molecular Formula | C38H44F2N6O11 |
Molecular Weight | 798.7864 |
Charge | 0 |
Count |
|
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 13:46:17 GMT 2023
by
admin
on
Sat Dec 16 13:46:17 GMT 2023
|
Record UNII |
6HHI72UPU8
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Common Name | English |
Code System | Code | Type | Description | ||
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137552079
Created by
admin on Sat Dec 16 13:46:17 GMT 2023 , Edited by admin on Sat Dec 16 13:46:17 GMT 2023
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2135438-17-2
Created by
admin on Sat Dec 16 13:46:17 GMT 2023 , Edited by admin on Sat Dec 16 13:46:17 GMT 2023
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PRIMARY | |||
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6HHI72UPU8
Created by
admin on Sat Dec 16 13:46:17 GMT 2023 , Edited by admin on Sat Dec 16 13:46:17 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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TARGET -> INHIBITOR |
IC50
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TARGET -> INHIBITOR |
IC50
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Related Record | Type | Details | ||
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PARENT -> METABOLITE ACTIVE |