Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C22H16N6O3 |
| Molecular Weight | 412.4017 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
c1ccc(c(c1)-c2ccc(cc2)Cn3c4c(cccc4nc3O)C(=O)O)-c5n[nH]nn5
InChI
InChIKey=KLCPKPIDOPBIQW-UHFFFAOYSA-N
InChI=1S/C22H16N6O3/c29-21(30)17-6-3-7-18-19(17)28(22(31)23-18)12-13-8-10-14(11-9-13)15-4-1-2-5-16(15)20-24-26-27-25-20/h1-11H,12H2,(H,23,31)(H,29,30)(H,24,25,26,27)
| Molecular Formula | C22H16N6O3 |
| Molecular Weight | 412.4017 |
| 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 Jun 26 09:37:55 UTC 2021
by
admin
on
Sat Jun 26 09:37:55 UTC 2021
|
| Record UNII |
RMN65A337Y
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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168434-02-4
Created by
admin on Sat Jun 26 09:37:56 UTC 2021 , Edited by admin on Sat Jun 26 09:37:56 UTC 2021
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10047287
Created by
admin on Sat Jun 26 09:37:56 UTC 2021 , Edited by admin on Sat Jun 26 09:37:56 UTC 2021
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RMN65A337Y
Created by
admin on Sat Jun 26 09:37:56 UTC 2021 , Edited by admin on Sat Jun 26 09:37:56 UTC 2021
|
PRIMARY | |||
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168434-02-4
Created by
admin on Sat Jun 26 09:37:56 UTC 2021 , Edited by admin on Sat Jun 26 09:37:56 UTC 2021
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
PLASMA; URINE
|
