5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid
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![5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/99566d8c35164d9ba8942eac2a246dca.png "5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid")
5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid
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CAS No:
22342-46-7
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Formula:
C9H18N2O2S
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Chemical Name:
5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid
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Synonyms:
diaminobiotin;diaminobiotin;Diamino Biotin;22342-46-7;5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid;UNII-643W0F9MUD;643W0F9MUD;2-Thiophenepentanoic acid, 3,4-diaminotetrahydro-, (2S,3S,4R)-;SCHEMBL7871714;DTXSID30364425;ZINC19367017;AKOS030241256;J-014648;Q27263695;2-Thiophenevaleric acid, 3,4-diaminotetrahydro-, (2S,3S,4R)-;5-((2S,3S,4R)-3,4-Diaminotetrahydrothiophen-2-yl)pentanoic acid;2-Thiophenepentanoic acid, 3,4-diaminotetrahydro-, (2S-(2alpha,3alpha,4alpha))-
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CAS No:
5-[(2S,3S,4R)-3,4-diaminothiolan-2-yl]pentanoic acid Basic Attributes
218.32 g/mol
218.10889899 g/mol
643W0F9MUD
DTXSID30364425
Computed Properties
Molecular Weight:218.32
XLogP3:-2.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:218.10889899
Monoisotopic Mass:218.10889899
Topological Polar Surface Area:115
Heavy Atom Count:14
Complexity:201
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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