Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C26H26F5N6O3.C2H6O.K |
| Molecular Weight | 650.6818 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[K+].CCO.FC1=C(F)C(=CC=C1)[C@@H]2CC[C@@H](NC(=O)N3CCC(CC3)N4C(=O)[N-]C5=C4C=CC=N5)C(=O)N(CC(F)(F)F)C2
InChI
InChIKey=VESUVMGLUABQCA-LEVQAPRMSA-M
InChI=1S/C26H27F5N6O3.C2H6O.K/c27-18-4-1-3-17(21(18)28)15-6-7-19(23(38)36(13-15)14-26(29,30)31)33-24(39)35-11-8-16(9-12-35)37-20-5-2-10-32-22(20)34-25(37)40;1-2-3;/h1-5,10,15-16,19H,6-9,11-14H2,(H2,32,33,34,39,40);3H,2H2,1H3;/q;;+1/p-1/t15-,19-;;/m1../s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C241
Created by
admin on Fri Dec 15 16:11:33 UTC 2023 , Edited by admin on Fri Dec 15 16:11:33 UTC 2023
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DBSALT002159
Created by
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L303VER2NG
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admin on Fri Dec 15 16:11:33 UTC 2023 , Edited by admin on Fri Dec 15 16:11:33 UTC 2023
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CHEMBL236593
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DTXSID30241808
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TT-82
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SUB34575
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953077-35-5
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100000128020
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admin on Fri Dec 15 16:11:33 UTC 2023 , Edited by admin on Fri Dec 15 16:11:33 UTC 2023
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46174140
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admin on Fri Dec 15 16:11:33 UTC 2023 , Edited by admin on Fri Dec 15 16:11:33 UTC 2023
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m10529
Created by
admin on Fri Dec 15 16:11:33 UTC 2023 , Edited by admin on Fri Dec 15 16:11:33 UTC 2023
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PRIMARY | Merck Index | ||
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C152546
Created by
admin on Fri Dec 15 16:11:33 UTC 2023 , Edited by admin on Fri Dec 15 16:11:33 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD