Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C21H27NO3 |
| Molecular Weight | 341.444 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1(C)C(C(=O)C2=CN(CCCCC(O)=O)C3=CC=CC=C23)C1(C)C
InChI
InChIKey=UUTHIAPDCFFQKQ-UHFFFAOYSA-N
InChI=1S/C21H27NO3/c1-20(2)19(21(20,3)4)18(25)15-13-22(12-8-7-11-17(23)24)16-10-6-5-9-14(15)16/h5-6,9-10,13,19H,7-8,11-12H2,1-4H3,(H,23,24)
| Molecular Formula | C21H27NO3 |
| Molecular Weight | 341.444 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:56:21 UTC 2023
by
admin
on
Sat Dec 16 10:56:21 UTC 2023
|
| Record UNII |
1USZ174277
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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1451369-33-7
Created by
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86268508
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1USZ174277
Created by
admin on Sat Dec 16 10:56:21 UTC 2023 , Edited by admin on Sat Dec 16 10:56:21 UTC 2023
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DTXSID401043095
Created by
admin on Sat Dec 16 10:56:21 UTC 2023 , Edited by admin on Sat Dec 16 10:56:21 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
ND to 7.9 pg/mg authentic human hair samples (n=14)
IN-VITRO
Scientific Literature
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