Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H22FN3O2S.C4H6O6 |
| Molecular Weight | 561.579 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.FC1=CC=C(C=C1)C(=O)C2CCN(CCN3C(=S)NC4=C(C=CC=C4)C3=O)CC2
InChI
InChIKey=VZGOQPXIRAHJLV-LREBCSMRSA-N
InChI=1S/C22H22FN3O2S.C4H6O6/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29;5-1(3(7)8)2(6)4(9)10/h1-8,16H,9-14H2,(H,24,29);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C66885
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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| Code System | Code | Type | Description | ||
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3033676
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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279-159-5
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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CHEMBL62919
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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DTXSID20229675
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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79449-96-0
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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C79965
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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9P204CHE8J
Created by
admin on Fri Dec 15 15:32:39 UTC 2023 , Edited by admin on Fri Dec 15 15:32:39 UTC 2023
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PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
