Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C25H25N3O3 |
| Molecular Weight | 415.4843 |
| Optical Activity | NONE |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | Meso |
SHOW SMILES / InChI
SMILES
CCN1C(=O)COC2=C1C=C(C3=CC=CC=C3)C(=N2)C4=CC=C(C=C4)[C@@]5(N)C[C@H](O)C5
InChI
InChIKey=BPHCAPAOSHZYJY-KJDSRRNHSA-N
InChI=1S/C25H25N3O3/c1-2-28-21-12-20(16-6-4-3-5-7-16)23(27-24(21)31-15-22(28)30)17-8-10-18(11-9-17)25(26)13-19(29)14-25/h3-12,19,29H,2,13-15,26H2,1H3/t19-,25+
| Molecular Formula | C25H25N3O3 |
| Molecular Weight | 415.4843 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:09:25 GMT 2023
by
admin
on
Sat Dec 16 18:09:25 GMT 2023
|
| Record UNII |
K2US8HW4TQ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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K2US8HW4TQ
Created by
admin on Sat Dec 16 18:09:26 GMT 2023 , Edited by admin on Sat Dec 16 18:09:26 GMT 2023
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1313439-71-2
Created by
admin on Sat Dec 16 18:09:26 GMT 2023 , Edited by admin on Sat Dec 16 18:09:26 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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TARGET -> INHIBITOR |
ALLOSTERIC
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TARGET -> INHIBITOR |
ALLOSTERIC
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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