1-dehydroxybaccatin VI
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1-dehydroxybaccatin VI
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CAS No:
125037-14-1
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Formula:
C37H46O13
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Chemical Name:
1-dehydroxybaccatin VI
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Synonyms:
1-dehydroxy-baccatin VI;1-dehydroxybaccatin VI;1-Deoxybaccatin VI;DTXSID80925000;(2aR-(2aalpha,4beta,4abeta,5alpha,6beta,9alpha,11beta,12alpha,12aalpha,12balpha))-3,4,4a,5,6,9,10,11,12,12a-Decahydro-4a,8,13,13-tetramethyl-7,14-methano-1H-cyclodeca(3,4)benz(1,2-b)oxete-4,5,6,9,12,12b(2aH)-hexol 4,5,6,9,12b-pentaacetate 12-benzoate;4,7,9,10,13-Pentakis(acetyloxy)-5,20-epoxytax-11-en-2-yl benzoate;7,14-Methano-1H-cyclodeca(3,4)benz(1,2-b)oxete-4,5,6,9,12,12b(2aH)-hexol, 3,4,4a,5,6,9,10,11,12,12a-decahydro-4a,8,13,13-tetramethyl-, 4,5,6,9,12b-pentaacetate 12-benzoate, (2aR-(2aalpha,4beta,4abeta,5alpha,6beta,9alpha,11beta,12alpha,12aalpha,12balpha))-
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CAS No:
Computed Properties
Molecular Weight:698.8
XLogP3:3.3
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:13
Exact Mass:698.29384152
Monoisotopic Mass:698.29384152
Topological Polar Surface Area:167
Heavy Atom Count:50
Complexity:1440
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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