Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H14N2O6 |
| Molecular Weight | 330.2922 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC(=O)C1=C(C)N=C(C)C(C(O)=O)=C1C2=C(C=CC=C2)[N+]([O-])=O
InChI
InChIKey=LCCVJQVUSQPANR-UHFFFAOYSA-N
InChI=1S/C16H14N2O6/c1-8-12(15(19)20)14(13(9(2)17-8)16(21)24-3)10-6-4-5-7-11(10)18(22)23/h4-7H,1-3H3,(H,19,20)
| Molecular Formula | C16H14N2O6 |
| Molecular Weight | 330.2922 |
| 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 09:06:19 GMT 2023
by
admin
on
Sat Dec 16 09:06:19 GMT 2023
|
| Record UNII |
4512W12AI3
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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4512W12AI3
Created by
admin on Sat Dec 16 09:06:19 GMT 2023 , Edited by admin on Sat Dec 16 09:06:19 GMT 2023
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DTXSID10994087
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admin on Sat Dec 16 09:06:19 GMT 2023 , Edited by admin on Sat Dec 16 09:06:19 GMT 2023
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175469
Created by
admin on Sat Dec 16 09:06:19 GMT 2023 , Edited by admin on Sat Dec 16 09:06:19 GMT 2023
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73372-63-1
Created by
admin on Sat Dec 16 09:06:19 GMT 2023 , Edited by admin on Sat Dec 16 09:06:19 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
Dehydrogenation step is catalysed by the cytochrome P450 (CYP) 3A4 enzyme
URINE
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PARENT -> METABOLITE |
PLASMA; URINE
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