8-oxo-14-thia-15-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaene-6-carboxylic acid
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![8-oxo-14-thia-15-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaene-6-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d221e23faa2a41b69fd75dd23ae49f91.png "8-oxo-14-thia-15-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaene-6-carboxylic acid")
8-oxo-14-thia-15-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaene-6-carboxylic acid
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CAS No:
6337-05-9
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Formula:
C15H7NO3S
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Chemical Name:
8-oxo-14-thia-15-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaene-6-carboxylic acid
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Synonyms:
MLS000737008;6337-05-9;NSC39938;CHEMBL1333486;SCHEMBL14228446;DTXSID30284952;HMS2756O21;ZINC1671640;NSC-39938;SMR000393965
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CAS No:
8-oxo-14-thia-15-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaene-6-carboxylic acid Basic Attributes
281.29 g/mol
281.01466426 g/mol
39938
DTXSID30284952
Computed Properties
Molecular Weight:281.29
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:281.01466426
Monoisotopic Mass:281.01466426
Topological Polar Surface Area:95.5
Heavy Atom Count:20
Complexity:454
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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