Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H24ClN7O5 |
| Molecular Weight | 513.934 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | ASSUMED STEREO DID NOT CHANGE UPON METABOLISM |
SHOW SMILES / InChI
SMILES
COC1=C(Cl)C=C(CNC2=NC(N[C@@H](CCC(O)=O)C=O)=NC=C2C(=O)NCC3=NC=CC=N3)C=C1
InChI
InChIKey=UXWCFSUGORGGDU-HNNXBMFYSA-N
InChI=1S/C23H24ClN7O5/c1-36-18-5-3-14(9-17(18)24)10-27-21-16(22(35)28-12-19-25-7-2-8-26-19)11-29-23(31-21)30-15(13-32)4-6-20(33)34/h2-3,5,7-9,11,13,15H,4,6,10,12H2,1H3,(H,28,35)(H,33,34)(H2,27,29,30,31)/t15-/m0/s1
| Molecular Formula | C23H24ClN7O5 |
| Molecular Weight | 513.934 |
| 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
Wed Apr 02 00:11:11 GMT 2025
by
admin
on
Wed Apr 02 00:11:11 GMT 2025
|
| Record UNII |
VBJ22PS3KX
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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VBJ22PS3KX
Created by
admin on Wed Apr 02 00:11:11 GMT 2025 , Edited by admin on Wed Apr 02 00:11:11 GMT 2025
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PRIMARY | |||
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155928892
Created by
admin on Wed Apr 02 00:11:11 GMT 2025 , Edited by admin on Wed Apr 02 00:11:11 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> METABOLITE |
