(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride
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![(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c09936994916475eabb1d3dbcee94eb3.png "(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride")
(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride
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CAS No:
63937-16-6
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Formula:
C27H44ClNO8
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Chemical Name:
(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride
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Synonyms:
Cevine HCl hydrate;Cevine hydrochloride dihydrate;Cevane-3-alpha,4-beta,12,14,16-beta,20-heptol, 4,9-epoxy-, hydrochloride, dihydrate;SCHEMBL14052458;63937-16-6
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CAS No:
(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride Basic Attributes
546.1 g/mol
545.2755451 g/mol
Computed Properties
Molecular Weight:546.1
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:9
Exact Mass:545.2755451
Monoisotopic Mass:545.2755451
Topological Polar Surface Area:155
Heavy Atom Count:37
Complexity:999
Defined Atom Stereocenter Count:11
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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