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Home > Encyclopedia > 7-epi-10-Deacetyltaxol

7-epi-10-Deacetyltaxol

7-epi-10-Deacetyltaxol structure

7-epi-10-Deacetyltaxol 

structure
  • CAS No:

    78454-17-8

  • Formula:

    C45H49NO13

  • Chemical Name:

    7-epi-10-Deacetyltaxol

  • Synonyms:

    Benzenepropanoic acid,β-(benzoylamino)-α-hydroxy-,(2aR,4R,4aS,6R,9S,11S,12S,12aR,12bS)-12b-(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,6,11-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)-;7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete,benzenepropanoic acid deriv.;7-Epi-10-deacetyltaxol;7-epi-10-Deacetyltaxol;10-Deacetyl-7-epitaxol;10-Deacetyl-7-epi-taxol;Ormosin VI;10-Desacetyl-7-epipaclitaxel;7-epi-10-Deacetylpaclitaxel;10-Deacetyl-7-epi-paclitaxel;10-Deacetyl-7-epipaclitaxel;111149-94-1;135501-18-7;176702-78-6

  • Categories:

    Natural Products  >  Terpenes

Description

7-Epi 10-desacetyl paclitaxel (7-epi-10-deacetyltaxol), a taxol derivative, exhibits cytotoxicity against HeLa cells with an IC50 of 85 μM[1][2].

7-epi-10-Deacetyltaxol Basic Attributes

811.87

811.87

PF8TD9Q8G5

DTXSID90559294

Characteristics

215

3.73970

1.41±0.1 g/cm3 (20 ºC 760 Torr)

163-170°C

H2O: Insuluble (2.4E-4 g/L) (25 ºC)

-20°C Freezer, Under Inert Atmosphere

Safety Information

NONH for all modes of transport

P201, P202, P260, P264, P270, P281, P308+P313, P314, P405, P501

H340

7-epi-10-Deacetyltaxol Use and Manufacturing

Paclitaxel impurity. Paclitaxel related compound B. The compound has been isolated from Taxus yunnanensis. It has shown to have potential growth inhibitory activities against human cancer cells.

Computed Properties

Molecular Weight:811.9
XLogP3:1.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:12
Exact Mass:811.32039062
Monoisotopic Mass:811.32039062
Topological Polar Surface Area:215
Heavy Atom Count:59
Complexity:1680
Defined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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