Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H12NO4S.Na |
| Molecular Weight | 289.283 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].COC1=CC=C2SCCN(CC2=C1)C(=O)C([O-])=O
InChI
InChIKey=OUNBYSZUAWDKLT-UHFFFAOYSA-M
InChI=1S/C12H13NO4S.Na/c1-17-9-2-3-10-8(6-9)7-13(4-5-18-10)11(14)12(15)16;/h2-3,6H,4-5,7H2,1H3,(H,15,16);/q;+1/p-1
Approval Year
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NCI_THESAURUS |
C47793
Created by
admin on Fri Dec 15 17:22:16 UTC 2023 , Edited by admin on Fri Dec 15 17:22:16 UTC 2023
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1233219-11-8
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YY-113
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300000044547
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CHEMBL2104951
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DTXSID90153953
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C142906
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RF69WW39TI
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56640724
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ACTIVE MOIETY
SUBSTANCE RECORD
