Yuanhuacine
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Yuanhuacine
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CAS No:
60195-70-2
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Formula:
C37H44O10
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Chemical Name:
Yuanhuacine
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Synonyms:
6H-2,8b-Epoxyoxireno[6,7]azuleno[5,4-e]-1,3-benzodioxol-6-one,10-(benzoyloxy)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-10a-(1-methylethenyl)-2-(1E,3E)-1,3-nonadien-1-yl-,(2S,3aR,3bS,3cS,4aR,5S,5aS,8aR,8bR,9R,10R,10aS)-;Simplexin,12-(benzoyloxy)-22,23,24,25-tetradehydro-,(12β,22E,24E)-;6H-2,8b-Epoxyoxireno[6,7]azuleno[5,4-e]-1,3-benzodioxol-6-one,10-(benzoyloxy)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-10a-(1-methylethenyl)-2-(1E,3E)-1,3-nonadienyl-,(2S,3aR,3bS,3cS,4aR,5S,5aS,8aR,8bR,9R,10R,10aS)-;(2S,3aR,3bS,3cS,4aR,5S,5aS,8aR,8bR,9R,10R,10aS)-10-(Benzoyloxy)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-10a-(1-methylethenyl)-2-(1E,3E)-1,3-nonadien-1-yl-6H-2,8b-epoxyoxireno[6,7]azuleno[5,4-e]-1,3-benzodioxol-6-one;Gnidilatidin;Odoracin;Yuanhuacin;Stillingia factor S6;Yuanhuacine;Yuanhuacium ester A;Yuanhuatie;6H-2,8b-Epoxyoxireno[6,7]azuleno[5,4-e]-1,3-benzodioxol-6-one,10-(benzoyloxy)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-10a-(1-methylethenyl)-2-(1,3-nonadienyl)-,[2S-[2α,2(1E,3E),3aβ,3bβ,3cβ,4aβ,5β,5aβ,8aα,8bα,9α,10β,10aβ]]-;NSC 261422;NSC 270919;6α,7α-Epoxy-5β-hydroxy-9,13,14-ortho-[(2E,4E)-deca-2,4-dien-1-yl]resiniferonol-12β-yl benzoate;YHL-14;61913-72-2;66673-22-1
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CAS No:
Computed Properties
Molecular Weight:648.7
XLogP3:4.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:11
Exact Mass:648.29344760
Monoisotopic Mass:648.29344760
Topological Polar Surface Area:144
Heavy Atom Count:47
Complexity:1410
Defined Atom Stereocenter Count:12
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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