Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C25H26N6O4 |
| Molecular Weight | 474.5117 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NC1=C2C(=NC=N1)N(N=C2C3=CC=C(OC4=CC=CC=C4)C=C3)[C@@H]5CCCN(C5)C(=O)C(O)CO
InChI
InChIKey=NWKPMPRXJGMTKQ-DIAVIDTQSA-N
InChI=1S/C25H26N6O4/c26-23-21-22(16-8-10-19(11-9-16)35-18-6-2-1-3-7-18)29-31(24(21)28-15-27-23)17-5-4-12-30(13-17)25(34)20(33)14-32/h1-3,6-11,15,17,20,32-33H,4-5,12-14H2,(H2,26,27,28)/t17-,20?/m1/s1
| Molecular Formula | C25H26N6O4 |
| Molecular Weight | 474.5117 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:14:17 GMT 2023
by
admin
on
Sat Dec 16 11:14:17 GMT 2023
|
| Record UNII |
29446230GA
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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29446230GA
Created by
admin on Sat Dec 16 11:14:17 GMT 2023 , Edited by admin on Sat Dec 16 11:14:17 GMT 2023
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91971609
Created by
admin on Sat Dec 16 11:14:17 GMT 2023 , Edited by admin on Sat Dec 16 11:14:17 GMT 2023
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1654820-87-7
Created by
admin on Sat Dec 16 11:14:17 GMT 2023 , Edited by admin on Sat Dec 16 11:14:17 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE ACTIVE |
Concentration higher than IBRUTINIB
MAJOR
PLASMA
|
