Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H20NO3.K |
| Molecular Weight | 325.4439 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[K+].CCC1=CC=CC2=C1NC3=C2CCO[C@@]3(CC)CC([O-])=O
InChI
InChIKey=VUVPSKOUJUOWDC-LMOVPXPDSA-M
InChI=1S/C17H21NO3.K/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12;/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20);/q;+1/p-1/t17-;/m0./s1
| Molecular Formula | C17H20NO3 |
| Molecular Weight | 286.3456 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | K |
| Molecular Weight | 39.0983 |
| Charge | 1 |
| 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
Mon Mar 31 21:03:31 GMT 2025
by
admin
on
Mon Mar 31 21:03:31 GMT 2025
|
| Record UNII |
C6SXT5145F
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
|
Preferred Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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170222-32-9
Created by
admin on Mon Mar 31 21:03:31 GMT 2025 , Edited by admin on Mon Mar 31 21:03:31 GMT 2025
|
PRIMARY | |||
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C6SXT5145F
Created by
admin on Mon Mar 31 21:03:31 GMT 2025 , Edited by admin on Mon Mar 31 21:03:31 GMT 2025
|
PRIMARY | |||
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124220557
Created by
admin on Mon Mar 31 21:03:31 GMT 2025 , Edited by admin on Mon Mar 31 21:03:31 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
RACEMATE -> ENANTIOMER |