Aguerin B
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Aguerin B
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CAS No:
68370-45-6
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Formula:
C19H22O5
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Chemical Name:
Aguerin B
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Synonyms:
2-Propenoic acid,2-methyl-,(3aR,4S,6aR,8S,9aR,9bR)-dodecahydro-8-hydroxy-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester;2-Propenoic acid,2-methyl-,dodecahydro-8-hydroxy-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester,[3aR-(3aα,4α,6aα,8β,9aα,9bβ)]-;Azuleno[4,5-b]furan,2-propenoic acid deriv.;Aguerin B;Arguerin B;4′-Deoxycynaropicrin
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CAS No:
Computed Properties
Molecular Weight:330.4
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:330.14672380
Monoisotopic Mass:330.14672380
Topological Polar Surface Area:72.8
Heavy Atom Count:24
Complexity:673
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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