(2S,5S,6S,8S,10S,17R,18S)-11-ethyl-3,6,18-trimethoxy-13-(methoxymethyl)-11-azoniahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol;chloride
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![(2S,5S,6S,8S,10S,17R,18S)-11-ethyl-3,6,18-trimethoxy-13-(methoxymethyl)-11-azoniahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol;chloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/94640df873194054ba27135230ea9242.png "(2S,5S,6S,8S,10S,17R,18S)-11-ethyl-3,6,18-trimethoxy-13-(methoxymethyl)-11-azoniahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol;chloride")
(2S,5S,6S,8S,10S,17R,18S)-11-ethyl-3,6,18-trimethoxy-13-(methoxymethyl)-11-azoniahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol;chloride
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CAS No:
58111-33-4
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Formula:
C25H42ClNO7
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Chemical Name:
(2S,5S,6S,8S,10S,17R,18S)-11-ethyl-3,6,18-trimethoxy-13-(methoxymethyl)-11-azoniahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol;chloride
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Synonyms:
Acomonine hydrochloride;Delsoline hydrochloride;O(sup 14)-Methyliliensine hydrochloride;58111-33-4;Aconitane-1,7,8-triol, 20-ethyl-4-(methoxymethyl)-6,14,16-trimethoxy-, monohydrochloride, (1-alpha,6-beta,14-alpha,16-beta)-
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CAS No:
(2S,5S,6S,8S,10S,17R,18S)-11-ethyl-3,6,18-trimethoxy-13-(methoxymethyl)-11-azoniahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol;chloride Basic Attributes
504.1 g/mol
503.2649804 g/mol
Computed Properties
Molecular Weight:504.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:503.2649804
Monoisotopic Mass:503.2649804
Topological Polar Surface Area:102
Heavy Atom Count:34
Complexity:829
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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