2-Butenoic acid, 2-methyl-, (1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester, (2E)-
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![2-Butenoic acid, 2-methyl-, (1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester, (2E)- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b1557da08c594eb7934bc0baf84f0ba3.png "2-Butenoic acid, 2-methyl-, (1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester, (2E)-")
2-Butenoic acid, 2-methyl-, (1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester, (2E)-
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CAS No:
26358-40-7
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Formula:
C20H24O6
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Chemical Name:
2-Butenoic acid, 2-methyl-, (1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester, (2E)-
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Synonyms:
2-Butenoic acid,2-methyl-,(1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester,(2E)-;2-Butenoic acid,2-methyl-,1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester,[1S-[1α,2β(R*),6β,7α(E),7aβ,10aα]]-;Ambrosa-2,11(13)-dien-12-oic acid,6α,8β,9β-trihydroxy-4-oxo-,δ-lactone,6-(2-methylcrotonate),(E)-;Linearifolin B
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CAS No:
2-Butenoic acid, 2-methyl-, (1S,2S,6S,7S,7aR,10aS,11S)-1,4,5,6,7,7a,8,10a-octahydro-11-hydroxy-1,7a-dimethyl-5-methylene-4,8-dioxo-2,6-methano-2H-cyclopent[d]oxonin-7-yl ester, (2E)- Basic Attributes
360.40096
360.40
Computed Properties
Molecular Weight:360.4
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:360.15728848
Monoisotopic Mass:360.15728848
Topological Polar Surface Area:89.9
Heavy Atom Count:26
Complexity:747
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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