Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H24FN3O4.2H2O |
| Molecular Weight | 425.4512 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.CN[C@@H]1CCCN(C1)C2=C(OC)C3=C(C=C2F)C(=O)C(=CN3C4CC4)C(O)=O
InChI
InChIKey=WEGNYJXOCPJAPS-NVJADKKVSA-N
InChI=1S/C20H24FN3O4.2H2O/c1-22-11-4-3-7-23(9-11)17-15(21)8-13-16(19(17)28-2)24(12-5-6-12)10-14(18(13)25)20(26)27;;/h8,10-12,22H,3-7,9H2,1-2H3,(H,26,27);2*1H2/t11-;;/m1../s1
| Molecular Formula | C20H24FN3O4 |
| Molecular Weight | 389.4207 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| 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
Sat Dec 16 08:43:42 UTC 2023
by
admin
on
Sat Dec 16 08:43:42 UTC 2023
|
| Record UNII |
643BMP2D2G
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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643BMP2D2G
Created by
admin on Sat Dec 16 08:43:42 UTC 2023 , Edited by admin on Sat Dec 16 08:43:42 UTC 2023
|
PRIMARY | |||
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5282514
Created by
admin on Sat Dec 16 08:43:42 UTC 2023 , Edited by admin on Sat Dec 16 08:43:42 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
|
|
RACEMATE -> ENANTIOMER |
