Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H18ClNO2 |
| Molecular Weight | 255.741 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H]1NC(C)(C)CO[C@@]1(O)C2=CC=CC(Cl)=C2
InChI
InChIKey=RCOBKSKAZMVBHT-TVQRCGJNSA-N
InChI=1S/C13H18ClNO2/c1-9-13(16,17-8-12(2,3)15-9)10-5-4-6-11(14)7-10/h4-7,9,15-16H,8H2,1-3H3/t9-,13+/m0/s1
| Molecular Formula | C13H18ClNO2 |
| Molecular Weight | 255.741 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:01:05 UTC 2023
by
admin
on
Fri Dec 15 16:01:05 UTC 2023
|
| Record UNII |
Q47741214K
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C66884
Created by
admin on Fri Dec 15 16:01:05 UTC 2023 , Edited by admin on Fri Dec 15 16:01:05 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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100000088382
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C81083
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8511
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SUB23070
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DTXSID501318447
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CHEMBL1172928
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Q47741214K
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DB11790
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RADAFAXINE
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C496215
Created by
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192374-14-4
Created by
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9795056
Created by
admin on Fri Dec 15 16:01:05 UTC 2023 , Edited by admin on Fri Dec 15 16:01:05 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE ACTIVE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
