Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C33H37F2N7O5S |
| Molecular Weight | 681.753 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C1=C(N2C(=O)N=C(N3CCN(C[C@@H]3C)C(=O)CCSC[C@H](N)C(O)=O)C4=CC(F)=C(N=C24)C5=C(O)C=CC=C5F)C(C)=CC=N1
InChI
InChIKey=ASOCVIRLUFTRNQ-CVDCTZTESA-N
InChI=1S/C33H37F2N7O5S/c1-17(2)27-29(18(3)8-10-37-27)42-31-20(14-22(35)28(38-31)26-21(34)6-5-7-24(26)43)30(39-33(42)47)41-12-11-40(15-19(41)4)25(44)9-13-48-16-23(36)32(45)46/h5-8,10,14,17,19,23,43H,9,11-13,15-16,36H2,1-4H3,(H,45,46)/t19-,23-/m0/s1
| Molecular Formula | C33H37F2N7O5S |
| Molecular Weight | 681.753 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 15:12:56 GMT 2025
by
admin
on
Wed Apr 02 15:12:56 GMT 2025
|
| Record UNII |
DX4J3XD28K
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Common Name | English | ||
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Preferred Name | English | ||
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Code | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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DX4J3XD28K
Created by
admin on Wed Apr 02 15:12:56 GMT 2025 , Edited by admin on Wed Apr 02 15:12:56 GMT 2025
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PRIMARY | |||
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166451420
Created by
admin on Wed Apr 02 15:12:56 GMT 2025 , Edited by admin on Wed Apr 02 15:12:56 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE INACTIVE |
Mediated primarily by nonenzymatic
glutathione conjugation
MAJOR
|
