Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H27NO6 |
| Molecular Weight | 341.3994 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC1=C(O)C=CC(=C1)[C@@H](O)CNCCCCCCOCC(O)=O
InChI
InChIKey=QVXZWBVIRZAZMV-INIZCTEOSA-N
InChI=1S/C17H27NO6/c19-11-14-9-13(5-6-15(14)20)16(21)10-18-7-3-1-2-4-8-24-12-17(22)23/h5-6,9,16,18-21H,1-4,7-8,10-12H2,(H,22,23)/t16-/m0/s1
| Molecular Formula | C17H27NO6 |
| Molecular Weight | 341.3994 |
| 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
Sat Dec 16 07:58:22 GMT 2023
by
admin
on
Sat Dec 16 07:58:22 GMT 2023
|
| Record UNII |
I4C90S3KVH
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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I4C90S3KVH
Created by
admin on Sat Dec 16 07:58:22 GMT 2023 , Edited by admin on Sat Dec 16 07:58:22 GMT 2023
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1463889-77-1
Created by
admin on Sat Dec 16 07:58:22 GMT 2023 , Edited by admin on Sat Dec 16 07:58:22 GMT 2023
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146675120
Created by
admin on Sat Dec 16 07:58:22 GMT 2023 , Edited by admin on Sat Dec 16 07:58:22 GMT 2023
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| Related Record | Type | Details | ||
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PARENT -> METABOLITE INACTIVE |
human beta-1 cAMP LANCE assay (n=7-24), a value is mean pEC50 (-logEC50); Vilanterol's beta-1 activity is 7.0 (pEC50)
IN-VITRO
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PARENT -> METABOLITE |
FECAL
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PARENT -> METABOLITE |
URINE
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