Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H21ClN6O4 |
| Molecular Weight | 480.904 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H]1CCN(CCN1C(=O)C2=C(C=CC(=C2)C(O)=O)N3N=CC=N3)C4=NC5=C(O4)C=CC(Cl)=C5
InChI
InChIKey=XVENCVVPKSCKJQ-CQSZACIVSA-N
InChI=1S/C23H21ClN6O4/c1-14-6-9-28(23-27-18-13-16(24)3-5-20(18)34-23)10-11-29(14)21(31)17-12-15(22(32)33)2-4-19(17)30-25-7-8-26-30/h2-5,7-8,12-14H,6,9-11H2,1H3,(H,32,33)/t14-/m1/s1
| Molecular Formula | C23H21ClN6O4 |
| Molecular Weight | 480.904 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:52:14 UTC 2023
by
admin
on
Sat Dec 16 14:52:14 UTC 2023
|
| Record UNII |
G8R68A764K
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Systematic Name | English | ||
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Systematic Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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1030377-38-8
Created by
admin on Sat Dec 16 14:52:14 UTC 2023 , Edited by admin on Sat Dec 16 14:52:14 UTC 2023
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PRIMARY | |||
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G8R68A764K
Created by
admin on Sat Dec 16 14:52:14 UTC 2023 , Edited by admin on Sat Dec 16 14:52:14 UTC 2023
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PRIMARY | |||
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24965988
Created by
admin on Sat Dec 16 14:52:14 UTC 2023 , Edited by admin on Sat Dec 16 14:52:14 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
M4 was the minor metabolite in plasma, but M4 was the major metabolite in urine and feces, accounting for 4.1% and 17.0% of the dose, respectively.
FECAL; PLASMA; URINE
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