Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H22N4O3.C4H4O4 |
| Molecular Weight | 506.5072 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.COC1=C(C)C(=C(C)C=N1)C2=CC=C3C4=C(C=NN4[C@H]5CCOC5)C(=O)NC3=C2
InChI
InChIKey=AFKSGMDXSLTKSU-DASCVMRKSA-N
InChI=1S/C22H22N4O3.C4H4O4/c1-12-9-23-22(28-3)13(2)19(12)14-4-5-16-18(8-14)25-21(27)17-10-24-26(20(16)17)15-6-7-29-11-15;5-3(6)1-2-4(7)8/h4-5,8-10,15H,6-7,11H2,1-3H3,(H,25,27);1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m0./s1
Approval Year
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| Code System | Code | Type | Description | ||
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HI-64
Created by
admin on Mon Mar 31 21:51:55 GMT 2025 , Edited by admin on Mon Mar 31 21:51:55 GMT 2025
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1630083-70-3
Created by
admin on Mon Mar 31 21:51:55 GMT 2025 , Edited by admin on Mon Mar 31 21:51:55 GMT 2025
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136289148
Created by
admin on Mon Mar 31 21:51:55 GMT 2025 , Edited by admin on Mon Mar 31 21:51:55 GMT 2025
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VEF2IPK30K
Created by
admin on Mon Mar 31 21:51:55 GMT 2025 , Edited by admin on Mon Mar 31 21:51:55 GMT 2025
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C179093
Created by
admin on Mon Mar 31 21:51:55 GMT 2025 , Edited by admin on Mon Mar 31 21:51:55 GMT 2025
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300000044454
Created by
admin on Mon Mar 31 21:51:55 GMT 2025 , Edited by admin on Mon Mar 31 21:51:55 GMT 2025
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD