Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C14H18N4O4 |
| Molecular Weight | 306.3171 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC(CC2=C(N)[N+]([O-])=C(N)N=C2)=CC(OC)=C1OC
InChI
InChIKey=WDZLEQOJJCXUSW-UHFFFAOYSA-N
InChI=1S/C14H18N4O4/c1-20-10-5-8(6-11(21-2)12(10)22-3)4-9-7-17-14(16)18(19)13(9)15/h5-7H,4,15H2,1-3H3,(H2,16,17)
| Molecular Formula | C14H18N4O4 |
| Molecular Weight | 306.3171 |
| 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 15:18:22 UTC 2023
by
admin
on
Sat Dec 16 15:18:22 UTC 2023
|
| Record UNII |
NVW7CIX03F
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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DTXSID30632419
Created by
admin on Sat Dec 16 15:18:22 UTC 2023 , Edited by admin on Sat Dec 16 15:18:22 UTC 2023
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PRIMARY | |||
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NVW7CIX03F
Created by
admin on Sat Dec 16 15:18:22 UTC 2023 , Edited by admin on Sat Dec 16 15:18:22 UTC 2023
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PRIMARY | |||
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27653-67-4
Created by
admin on Sat Dec 16 15:18:22 UTC 2023 , Edited by admin on Sat Dec 16 15:18:22 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
CYP1A1 and CYP1B1 were the heterologously expressed enzymes that catalyzed the highest rates of 3-NO-TMP formation.
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PARENT -> METABOLITE |
CYP1A1 and CYP1B1 were the heterologously expressed enzymes that catalyzed the highest rates of 3-NO-TMP formation.
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