Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H20NO3.Na |
Molecular Weight | 309.3354 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CCC1=CC=CC2=C1NC3=C2CCO[C@]3(CC)CC([O-])=O
InChI
InChIKey=OYVVSFKYBAVZJZ-UNTBIKODSA-M
InChI=1S/C17H21NO3.Na/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-;/m1./s1
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:54:03 UTC 2023
by
admin
on
Sat Dec 16 01:54:03 UTC 2023
|
Record UNII |
2V61D87073
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Common Name | English | ||
|
Systematic Name | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
101602496
Created by
admin on Sat Dec 16 01:54:03 UTC 2023 , Edited by admin on Sat Dec 16 01:54:03 UTC 2023
|
PRIMARY | |||
|
2V61D87073
Created by
admin on Sat Dec 16 01:54:03 UTC 2023 , Edited by admin on Sat Dec 16 01:54:03 UTC 2023
|
PRIMARY | |||
|
150975-87-4
Created by
admin on Sat Dec 16 01:54:03 UTC 2023 , Edited by admin on Sat Dec 16 01:54:03 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
RACEMATE -> ENANTIOMER |