Description
5-Acetyltaxachitriene A is extracted from the needles of Taxus mairei.
Synonyms
Bicyclo[9.3.1]pentadeca-3,8,14-triene-2,3,5,7,10,13-hexol, 8-[(acetyloxy)methyl]-4,14,15,15-tetramethyl-, hexaacetate, (2R,3E,5S,7S,8E,10S,11R,13S)-; (2R,3E,5R,7S,8E,10S,11R,13S)-8-(acetoxymethyl)-4,14,15,15-tetramethylbicyclo[9.3.1]pentadeca-1(14),3,8-triene-2,3,5,7,10,13-hexayl hexaacetate
IUPAC Name
[(1R,2S,3E,5S,7R,8E,10R,13S)-2,5,7,9,10,13-hexaacetyloxy-8,12,15,15-tetramethyl-4-bicyclo[9.3.1]pentadeca-3,8,11-trienyl]methyl acetate
Molecular Formula
C34H46O14
Canonical SMILES
CC1=C2C(C(=C(C(CC(C(=CC(C(C2(C)C)CC1OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C
InChI
InChI=1S/C34H46O14/c1-16-27(43-19(4)36)13-26-30(46-22(7)39)12-25(15-42-18(3)35)29(45-21(6)38)14-28(44-20(5)37)17(2)32(47-23(8)40)33(48-24(9)41)31(16)34(26,10)11/h12,26-30,33H,13-15H2,1-11H3/b25-12+,32-17+/t26-,27-,28+,29-,30-,33+/m0/s1
InChIKey
CVVZHAQTJYVJBN-OSCBSIQTSA-N
Boiling Point
687.5±55.0°C at 760 mmHg
Solubility
Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate