Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H22ClN5O3 |
| Molecular Weight | 391.852 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(Cl)C=C(CNC2=NC(=NC=C2C(N)=O)N3CCC[C@H]3CO)C=C1
InChI
InChIKey=DOFKMUMGUZOQSB-LBPRGKRZSA-N
InChI=1S/C18H22ClN5O3/c1-27-15-5-4-11(7-14(15)19)8-21-17-13(16(20)26)9-22-18(23-17)24-6-2-3-12(24)10-25/h4-5,7,9,12,25H,2-3,6,8,10H2,1H3,(H2,20,26)(H,21,22,23)/t12-/m0/s1
| Molecular Formula | C18H22ClN5O3 |
| Molecular Weight | 391.852 |
| 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
Mon Mar 31 23:03:42 GMT 2025
by
admin
on
Mon Mar 31 23:03:42 GMT 2025
|
| Record UNII |
0GSC2KM5HE
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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372117-54-9
Created by
admin on Mon Mar 31 23:03:42 GMT 2025 , Edited by admin on Mon Mar 31 23:03:42 GMT 2025
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0GSC2KM5HE
Created by
admin on Mon Mar 31 23:03:42 GMT 2025 , Edited by admin on Mon Mar 31 23:03:42 GMT 2025
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58863329
Created by
admin on Mon Mar 31 23:03:42 GMT 2025 , Edited by admin on Mon Mar 31 23:03:42 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |