Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C22H21N3O5 |
| Molecular Weight | 407.4192 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COCCOC1=CC2=C(C=C1OCCOC)C(\N=C3\C=CC(=O)C(=C3)C#C)=NC=N2
InChI
InChIKey=NZKODLGRMXYYIO-XYGWBWBKSA-N
InChI=1S/C22H21N3O5/c1-4-15-11-16(5-6-19(15)26)25-22-17-12-20(29-9-7-27-2)21(30-10-8-28-3)13-18(17)23-14-24-22/h1,5-6,11-14H,7-10H2,2-3H3/b25-16-
| Molecular Formula | C22H21N3O5 |
| Molecular Weight | 407.4192 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 03:47:52 GMT 2025
by
admin
on
Wed Apr 02 03:47:52 GMT 2025
|
| Record UNII |
8WJW95YV4U
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
| Name | Type | Language | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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8WJW95YV4U
Created by
admin on Wed Apr 02 03:47:52 GMT 2025 , Edited by admin on Wed Apr 02 03:47:52 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
Mediated thru CYP3A4/1A1 and produced thru aromatic hydroxylation.
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