(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol
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![(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3e2835b5f8104229b5d11c3d3007306c.png "(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol")
(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol
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CAS No:
88704-50-1
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Formula:
C14H16BrN3O2S
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Chemical Name:
(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol
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Synonyms:
[1,6,2]Oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol,1-amino-11-bromo-1,2,7,8,13,13b-hexahydro-,(1S,13bS)-;[1,6,2]Oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol,1-amino-11-bromo-1,2,7,8,13,13b-hexahydro-,(1S-trans)-;(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol;Eudistomine C;Eudistomin C;(-)-Eudistomine C
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CAS No:
(1S,13bS)-1-Amino-11-bromo-1,2,7,8,13,13b-hexahydro[1,6,2]oxathiazepino[2′,3′:1,2]pyrido[3,4-b]indol-10-ol Basic Attributes
370.27 g/mol
370.26
722496
Computed Properties
Molecular Weight:370.27
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Exact Mass:369.01466
Monoisotopic Mass:369.01466
Topological Polar Surface Area:99.8
Heavy Atom Count:21
Complexity:404
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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