Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C25H34FN3O2.C4H6O6 |
| Molecular Weight | 1005.1964 |
| 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.CC(C)COC1=CC=C(CNC(=O)N(CC2=CC=C(F)C=C2)C3CCN(C)CC3)C=C1.CC(C)COC4=CC=C(CNC(=O)N(CC5=CC=C(F)C=C5)C6CCN(C)CC6)C=C4
InChI
InChIKey=RGSULKHNAKTFIZ-CEAXSRTFSA-N
InChI=1S/2C25H34FN3O2.C4H6O6/c2*1-19(2)18-31-24-10-6-20(7-11-24)16-27-25(30)29(23-12-14-28(3)15-13-23)17-21-4-8-22(26)9-5-21;5-1(3(7)8)2(6)4(9)10/h2*4-11,19,23H,12-18H2,1-3H3,(H,27,30);1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1
Approval Year
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NCI_THESAURUS |
C66885
Created by
admin on Fri Dec 15 15:34:21 UTC 2023 , Edited by admin on Fri Dec 15 15:34:21 UTC 2023
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C80764
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SUB128275
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706782-28-7
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m11934
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CHEMBL2111101
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SS-125
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11672491
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NA83F1SJSR
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1791686
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NA83F1SJSR
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DTXSID50220958
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DBSALT001266
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133014
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100000153826
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ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD