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=C2[C@H]3C[C@H](O)[C@H](CC(C)C)CN3CCC2=C1
InChI
InChIKey=QPCCFQGYORNUSE-DWSRUFIWSA-N
InChI=1S/C18H27NO3/c1-11(2)6-13-10-19-5-4-12-7-18(22-3)17(21)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 13:40:44 UTC 2023
by
admin
on
Sat Dec 16 13:40:44 UTC 2023
|
| Record UNII |
QAE3F6U174
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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QAE3F6U174
Created by
admin on Sat Dec 16 13:40:45 UTC 2023 , Edited by admin on Sat Dec 16 13:40:45 UTC 2023
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117693284
Created by
admin on Sat Dec 16 13:40:45 UTC 2023 , Edited by admin on Sat Dec 16 13:40:45 UTC 2023
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1977511-09-3
Created by
admin on Sat Dec 16 13:40:45 UTC 2023 , Edited by admin on Sat Dec 16 13:40:45 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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