β-Artelinic acid
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β-Artelinic acid
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CAS No:
120020-26-0
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Formula:
C23H30O7
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Chemical Name:
β-Artelinic acid
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Synonyms:
Benzoic acid,4-[[[(3R,5aS,6R,8aS,9R,10S,12R,12aR)-decahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl]oxy]methyl]-;Benzoic acid,4-[[(decahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl)oxy]methyl]-,[3R-(3α,5aβ,6β,8aβ,9α,10α,12β,12aR*)]-;3,12-Epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin,benzoic acid deriv.;4-[[[(3R,5aS,6R,8aS,9R,10S,12R,12aR)-Decahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl]oxy]methyl]benzoic acid;Artelinic acid;β-Artelinic acid;109637-83-4
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CAS No:
Drug Information
Beta-artelinic acid has known human metabolites that include Dihydroqinghaosu (DQHS).
artelinic acid
Computed Properties
Molecular Weight:418.5
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:418.19915329
Monoisotopic Mass:418.19915329
Topological Polar Surface Area:83.4
Heavy Atom Count:30
Complexity:662
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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