2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid
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![2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6806c1d8ee45465e94a5e2167b731d35.png "2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid")
2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid
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CAS No:
77482-44-1
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Formula:
C7H13N3O4S
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Chemical Name:
2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid
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Synonyms:
GEMSA;guanidinoethylmercaptosuccinic acid;gemsa;77482-44-1;2-GUANIDINOETHYLMERCAPTOSUCCINIC ACID;DL-guanidinoethylmercaptosuccinic acid;CHEMBL560871;2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid;Butanedioic acid,2-[[2-[(aminoiminomethyl)amino]ethyl]thio]-;GUANIDINOETHYLMERCAPTO-SUCCINIC ACID;SCHEMBL1765999;2-Guanidinoethylthiosuccinic acid;BDBM50296412;2-[(2-carbamimidamidoethyl)sulfanyl]butanedioic acid;Butanedioic acid, ((2-((aminoiminomethyl)amino)ethyl)thio)-
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CAS No:
2-[2-(diaminomethylideneamino)ethylsulfanyl]butanedioic acid Basic Attributes
235.26 g/mol
235.06267708 g/mol
Computed Properties
Molecular Weight:235.26
XLogP3:-1.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:235.06267708
Monoisotopic Mass:235.06267708
Topological Polar Surface Area:164
Heavy Atom Count:15
Complexity:265
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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