2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)-
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![2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/931dc8df496f4839ac6145115a7ae9fd.png "2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)-")
2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)-
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CAS No:
38456-39-2
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Formula:
C20H26O6
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Chemical Name:
2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)-
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Synonyms:
2-Butenoic acid,2-(hydroxymethyl)-,(3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester,(2Z)-;2-Butenoic acid,2-(hydroxymethyl)-,2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester,[3aR-[3aR*,4R*(Z),6E,8S*,10E,11aR*]]-;Cyclodeca[b]furan,2-butenoic acid deriv.;Deacetyleupaserrin;Desacetyleupaserrin
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CAS No:
2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)- Basic Attributes
362.41700
362.42
Computed Properties
Molecular Weight:362.4
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:362.17293854
Monoisotopic Mass:362.17293854
Topological Polar Surface Area:93.1
Heavy Atom Count:26
Complexity:684
Defined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Butenoic acid, 2-(hydroxymethyl)-, (3aR,4R,6E,8S,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2Z)-
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