Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C26H28ClNO.C6H8O7 |
| Molecular Weight | 598.083 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CN(C)CCOC1=CC=C(C=C1)C(=C(\CCCl)C2=CC=CC=C2)\C3=CC=CC=C3
InChI
InChIKey=IWEQQRMGNVVKQW-OQKDUQJOSA-N
InChI=1S/C26H28ClNO.C6H8O7/c1-28(2)19-20-29-24-15-13-23(14-16-24)26(22-11-7-4-8-12-22)25(17-18-27)21-9-5-3-6-10-21;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-16H,17-20H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b26-25-;
Approval Year
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NCI_THESAURUS |
C1821
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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| Code System | Code | Type | Description | ||
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2498Y783QT
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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C1756
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Z-51
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613680
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2498Y783QT
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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49953
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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DTXSID2021367
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admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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DBSALT001447
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admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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m10979
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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100000085256
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3005572
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SUB04923MIG
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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CHEMBL1655
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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89778-27-8
Created by
admin on Fri Dec 15 15:09:55 UTC 2023 , Edited by admin on Fri Dec 15 15:09:55 UTC 2023
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ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
