Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C50H66Cl4N8O10S2 |
Molecular Weight | 1145.049 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1C[C@@H](C2=CC=CC(=C2)S(=O)(=O)NCCOCCOCCNC(=O)NCCCCNC(=O)NCCOCCOCCNS(=O)(=O)C3=CC(=CC=C3)[C@@H]4CN(C)CC5=C4C=C(Cl)C=C5Cl)C6=C(C1)C(Cl)=CC(Cl)=C6
InChI
InChIKey=DNHPDWGIXIMXSA-CXNSMIOJSA-N
InChI=1S/C50H66Cl4N8O10S2/c1-61-31-43(41-27-37(51)29-47(53)45(41)33-61)35-7-5-9-39(25-35)73(65,66)59-15-19-71-23-21-69-17-13-57-49(63)55-11-3-4-12-56-50(64)58-14-18-70-22-24-72-20-16-60-74(67,68)40-10-6-8-36(26-40)44-32-62(2)34-46-42(44)28-38(52)30-48(46)54/h5-10,25-30,43-44,59-60H,3-4,11-24,31-34H2,1-2H3,(H2,55,57,63)(H2,56,58,64)/t43-,44-/m0/s1
Approval Year
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C78276
Created by
admin on Sat Dec 16 03:59:38 UTC 2023 , Edited by admin on Sat Dec 16 03:59:38 UTC 2023
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300000034408
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C152555
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DB11761
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2199674
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5349
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9652
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Tenapanor
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WYD79216A6
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Tenapanor
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WYD79216A6
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1234423-95-0
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71587953
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m12162
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DTXSID40154016
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admin on Sat Dec 16 03:59:38 UTC 2023 , Edited by admin on Sat Dec 16 03:59:38 UTC 2023
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ACTIVE MOIETY
SALT/SOLVATE (PARENT)