Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H27NO3 |
| Molecular Weight | 308.4304 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[2H]C([2H])([2H])OC1=C(O)C=C2CCN3C[C@@H](CC(C)C)[C@@H](O)C[C@@H]3C2=C1
InChI
InChIKey=NNGHNWCGIHBKHE-DWSRUFIWSA-N
InChI=1S/C18H27NO3/c1-11(2)6-13-10-19-5-4-12-7-17(21)18(22-3)8-14(12)15(19)9-16(13)20/h7-8,11,13,15-16,20-21H,4-6,9-10H2,1-3H3/t13-,15-,16+/m1/s1/i3D3
| Molecular Formula | C18H27NO3 |
| Molecular Weight | 308.4304 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 13:40:43 UTC 2023
by
admin
on
Sat Dec 16 13:40:43 UTC 2023
|
| Record UNII |
YK0BSS171M
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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YK0BSS171M
Created by
admin on Sat Dec 16 13:40:44 UTC 2023 , Edited by admin on Sat Dec 16 13:40:44 UTC 2023
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146014896
Created by
admin on Sat Dec 16 13:40:44 UTC 2023 , Edited by admin on Sat Dec 16 13:40:44 UTC 2023
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1977511-08-2
Created by
admin on Sat Dec 16 13:40:44 UTC 2023 , Edited by admin on Sat Dec 16 13:40:44 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> RACEMATE |
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ENANTIOMER -> RACEMATE |
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| Related Record | Type | Details | ||
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PARENT -> METABOLITE |
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