6α,3′-p-Dihydroxypaclitaxel
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6α,3′-p-Dihydroxypaclitaxel
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CAS No:
157230-10-9
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Formula:
C47H51NO16
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Chemical Name:
6α,3′-p-Dihydroxypaclitaxel
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Synonyms:
Benzenepropanoic acid,β-(benzoylamino)-α,4-dihydroxy-,(2aR,3S,4R,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-bis(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-3,4,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester,(αR,βS)-;Benzenepropanoic acid,β-(benzoylamino)-α,4-dihydroxy-,6,12b-bis(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-3,4,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxet-9-yl ester,[2aR-[2aα,3α,4β,4aβ,6β,9α(αR*,βS*),11α,12α,12aα,12bα]]-;7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete,benzenepropanoic acid deriv.;6α,3′-p-Dihydroxypaclitaxel;172228-57-8
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CAS No:
Computed Properties
Molecular Weight:885.9
XLogP3:1.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:14
Exact Mass:885.32078454
Monoisotopic Mass:885.32078454
Topological Polar Surface Area:262
Heavy Atom Count:64
Complexity:1860
Defined Atom Stereocenter Count:12
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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