Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H28F5N3O5 |
| Molecular Weight | 617.5631 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C=CC=C3F)C(F)(F)F)C4=CC=CC(O)=C4F
InChI
InChIKey=DZVOEOFOGMCCEU-DEOSSOPVSA-N
InChI=1S/C31H28F5N3O5/c1-18-27(20-10-5-13-25(40)28(20)33)29(43)39(17-24(19-8-3-2-4-9-19)37-15-7-14-26(41)42)30(44)38(18)16-21-22(31(34,35)36)11-6-12-23(21)32/h2-6,8-13,24,37,40H,7,14-17H2,1H3,(H,41,42)/t24-/m0/s1
| Molecular Formula | C31H28F5N3O5 |
| Molecular Weight | 617.5631 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 02:11:25 GMT 2025
by
admin
on
Wed Apr 02 02:11:25 GMT 2025
|
| Record UNII |
B3LWK12L14
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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137528260
Created by
admin on Wed Apr 02 02:11:25 GMT 2025 , Edited by admin on Wed Apr 02 02:11:25 GMT 2025
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832720-51-1
Created by
admin on Wed Apr 02 02:11:25 GMT 2025 , Edited by admin on Wed Apr 02 02:11:25 GMT 2025
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PRIMARY | |||
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B3LWK12L14
Created by
admin on Wed Apr 02 02:11:25 GMT 2025 , Edited by admin on Wed Apr 02 02:11:25 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
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