Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H21NO5 |
| Molecular Weight | 319.353 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1[C@]2([H])CC[C@]1([H])[C@]([H])([C@]([H])(C2)OC(=O)c3ccccc3O)C(=O)OC
InChI
InChIKey=PEISRHQJLATJPJ-WAZAZEMKSA-N
InChI=1S/C17H21NO5/c1-18-10-7-8-12(18)15(17(21)22-2)14(9-10)23-16(20)11-5-3-4-6-13(11)19/h3-6,10,12,14-15,19H,7-9H2,1-2H3/t10-,12-,14+,15-/m1/s1
| Molecular Formula | C17H21NO5 |
| Molecular Weight | 319.353 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Jun 25 20:48:00 UTC 2021
by
admin
on
Fri Jun 25 20:48:00 UTC 2021
|
| Record UNII |
K8J4W658QK
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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89339-17-3
Created by
admin on Fri Jun 25 20:48:00 UTC 2021 , Edited by admin on Fri Jun 25 20:48:00 UTC 2021
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K8J4W658QK
Created by
admin on Fri Jun 25 20:48:00 UTC 2021 , Edited by admin on Fri Jun 25 20:48:00 UTC 2021
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71461615
Created by
admin on Fri Jun 25 20:48:00 UTC 2021 , Edited by admin on Fri Jun 25 20:48:00 UTC 2021
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
TRANSPORTER->LIGAND | |||
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TARGET->ANALOGUE | |||
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TRANSPORTER->LIGAND | |||
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PARENT -> DERIVATIVE | |||
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TRANSPORTER->LIGAND |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE ACTIVE |