Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C21H28N4O3.H2O.H2O4S |
| Molecular Weight | 500.566 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.OS(O)(=O)=O.CN(C1CCCCC1)C(=O)CCCOC2=CC=C3NC4=NC(=O)CN4CC3=C2
InChI
InChIKey=IXJGUUXNDBSBPT-UHFFFAOYSA-N
InChI=1S/C21H28N4O3.H2O4S.H2O/c1-24(16-6-3-2-4-7-16)20(27)8-5-11-28-17-9-10-18-15(12-17)13-25-14-19(26)23-21(25)22-18;1-5(2,3)4;/h9-10,12,16H,2-8,11,13-14H2,1H3,(H,22,23,26);(H2,1,2,3,4);1H2
Approval Year
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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50S40MPD5U
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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DTXSID40144073
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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C166796
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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CHEMBL69139
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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135566105
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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T-66
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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101626-67-9
Created by
admin on Fri Dec 15 15:43:45 UTC 2023 , Edited by admin on Fri Dec 15 15:43:45 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD