Baccatin VI

Diterpenoids

NP1470

57672-79-4

Baccatin VI

Baccatin VI is extracted from the heartwood of Taxus baccata L and belongs taxane derivative. It shows significant antinociceptive activity against p-benzoquinone-induced abdominal contractions. It is a neoplasm inhibitor to breast and ovarian cancers.

7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-4,5,6,9,11,12,12b-heptol, 2a,3,4,4a,5,6,9,10,12,12a-decahydro-4a,8,13,13-tetramethyl-, 4,5,6,9,12b-pentaacetate 12-benzoate, (2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-; 5β,20-Epoxytaxa-11-ene-1,2α,4,7β,9α,10β,13α-heptol 2-benzoate 4,7,9,10,13-pentaacetate; (2aR,4S,4aS,5R,6R,9S,11S,12S,12aR,12bS)-2a,3,4,4a,5,6,9,10,12,12a-Decahydro-4a,8,13,13-tetramethyl-4,5,6,9,12b-pentaacetate 12-Benzoate Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-4,5,6,9,11,12,12b-heptol; (5beta,7alpha,9alpha,10alpha,13alpha)-4,7,9,10,13-Pentakis(acetyloxy)-1-hydroxy-5,20-epoxytax-11-en-2-yl benzoate; 7,11-Methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-4,5,6,9,11,12,12b-heptol, 2a,3,4,4a,5,6,9,10,12,12a-decahydro-4a,8,13,13-tetramethyl-, 4,5,6,9,12b-pentaacetate 12-benzoate, [2aR-(2aα,4β,4aβ,5α,6β,9α,11α,12α,12aα,12bα)]-

[(1S,2S,3R,4S,7R,9S,10S,11R,12R,15S)-4,9,11,12,15-pentaacetyloxy-1-hydroxy-10,14,17,17-tetramethyl-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate

714.75

C37H46O14

CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C

InChI=1S/C37H46O14/c1-18-25(46-19(2)38)16-37(44)32(50-33(43)24-13-11-10-12-14-24)30-35(9,26(47-20(3)39)15-27-36(30,17-45-27)51-23(6)42)31(49-22(5)41)29(48-21(4)40)28(18)34(37,7)8/h10-14,25-27,29-32,44H,15-17H2,1-9H3/t25-,26-,27+,29+,30-,31-,32-,35+,36-,37+/m0/s1

UJFKTEIDORFVQS-SKNQRQHZSA-N

716.6±60.0°C at 760 mmHg

>220°C (dec.)

98.0%

1.33±0.1 g/cm3

Soluble in Acetone (Slightly), Chloroform (Slightly), Ethyl Acetate (Slightly)

Pale Brown Solid

Store at 2-8°C

Yellow

Powder

12.43±0.70(Predicted)

A taxane derivative, a neoplasm inhibitor to ovarian and breast cancers found in Taxus species