Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H11I3N2O4.C7H17NO5 |
| Molecular Weight | 823.1537 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CN(C(C)=O)C1=C(I)C(NC(C)=O)=C(I)C(C(O)=O)=C1I
InChI
InChIKey=TXKOGNLDVKUFSI-WZTVWXICSA-N
InChI=1S/C12H11I3N2O4.C7H17NO5/c1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19;1-8-2-4(10)6(12)7(13)5(11)3-9/h1-3H3,(H,16,18)(H,20,21);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C390
Created by
admin on Fri Dec 15 14:57:37 UTC 2023 , Edited by admin on Fri Dec 15 14:57:37 UTC 2023
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DBSALT001369
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100000086396
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C021342
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RJY6JR42WQ
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SUB03123MIG
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10056264
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CHEMBL1736
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7241-11-4
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230-641-3
Created by
admin on Fri Dec 15 14:57:37 UTC 2023 , Edited by admin on Fri Dec 15 14:57:37 UTC 2023
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C95058
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admin on Fri Dec 15 14:57:37 UTC 2023 , Edited by admin on Fri Dec 15 14:57:37 UTC 2023
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DTXSID40993205
Created by
admin on Fri Dec 15 14:57:37 UTC 2023 , Edited by admin on Fri Dec 15 14:57:37 UTC 2023
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PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
