Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C15H16I3NO3 |
| Molecular Weight | 639.0059 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCC(=O)NC1=C(I)C(C=C(CC)C(O)=O)=C(I)C=C1I
InChI
InChIKey=CWRBDUIQDIHWJZ-SOFGYWHQSA-N
InChI=1S/C15H16I3NO3/c1-3-5-12(20)19-14-11(17)7-10(16)9(13(14)18)6-8(4-2)15(21)22/h6-7H,3-5H2,1-2H3,(H,19,20)(H,21,22)/b8-6+
| Molecular Formula | C15H16I3NO3 |
| Molecular Weight | 639.0059 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 17:57:57 GMT 2025
by
admin
on
Mon Mar 31 17:57:57 GMT 2025
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| Record UNII |
IX9VVF69JR
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C28500
Created by
admin on Mon Mar 31 17:57:57 GMT 2025 , Edited by admin on Mon Mar 31 17:57:57 GMT 2025
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| Code System | Code | Type | Description | ||
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CHEMBL2110636
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3048
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DB04814
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m2760
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PRIMARY | Merck Index | ||
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C83565
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C044453
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100000088445
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DTXSID20862607
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admin on Mon Mar 31 17:57:57 GMT 2025 , Edited by admin on Mon Mar 31 17:57:57 GMT 2025
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IX9VVF69JR
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15985
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1233-53-0
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898
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admin on Mon Mar 31 17:57:57 GMT 2025 , Edited by admin on Mon Mar 31 17:57:57 GMT 2025
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SUB05975MIG
Created by
admin on Mon Mar 31 17:57:57 GMT 2025 , Edited by admin on Mon Mar 31 17:57:57 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |