Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H27NO3 |
| Molecular Weight | 305.4119 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC2=C(C=C1O)[C@H]3C[C@@H](O)[C@H](CC(C)C)CN3CC2
InChI
InChIKey=QPCCFQGYORNUSE-FVQBIDKESA-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
| Molecular Formula | C18H27NO3 |
| Molecular Weight | 305.4119 |
| 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
Tue Apr 01 21:09:22 GMT 2025
by
admin
on
Tue Apr 01 21:09:22 GMT 2025
|
| Record UNII |
DK3H75E8YD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
1214267-79-4
Created by
admin on Tue Apr 01 21:09:22 GMT 2025 , Edited by admin on Tue Apr 01 21:09:22 GMT 2025
|
PRIMARY | |||
|
DK3H75E8YD
Created by
admin on Tue Apr 01 21:09:22 GMT 2025 , Edited by admin on Tue Apr 01 21:09:22 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ENANTIOMER -> RACEMATE |
|
||
|
ENANTIOMER -> RACEMATE |
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> METABOLITE |
|
