Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C28H36N4O3S |
| Molecular Weight | 508.675 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O=C1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)N1C[C@@H]4CCCC[C@H]4CN5CCN(CC5)C6=NS(=O)C7=C6C=CC=C7
InChI
InChIKey=MDYJLJKDGQUHSJ-HTWOXQOSSA-N
InChI=1S/C28H36N4O3S/c33-27-24-18-9-10-19(15-18)25(24)28(34)32(27)17-21-6-2-1-5-20(21)16-30-11-13-31(14-12-30)26-22-7-3-4-8-23(22)36(35)29-26/h3-4,7-8,18-21,24-25H,1-2,5-6,9-17H2/t18-,19+,20-,21-,24+,25-,36?/m0/s1
| Molecular Formula | C28H36N4O3S |
| Molecular Weight | 508.675 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 01:14:47 GMT 2025
by
admin
on
Wed Apr 02 01:14:47 GMT 2025
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| Record UNII |
QX95ZN7H2D
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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1809325-45-8
Created by
admin on Wed Apr 02 01:14:47 GMT 2025 , Edited by admin on Wed Apr 02 01:14:47 GMT 2025
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QX95ZN7H2D
Created by
admin on Wed Apr 02 01:14:47 GMT 2025 , Edited by admin on Wed Apr 02 01:14:47 GMT 2025
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129011995
Created by
admin on Wed Apr 02 01:14:47 GMT 2025 , Edited by admin on Wed Apr 02 01:14:47 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
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