Baccatin IV

Inquiry

For Research Use Only.

Category

Diterpenoids

Cat.No.

NP1481

CAS

57672-77-2

Product Name

Baccatin IV

Structure

Product Details

Description

Baccatin IV is extracted from the barks of Taxus chinensis.

Synonyms

(2aR)-2a,3,4,4a,5,6,9,10,12,12aβ-Decahydro-4aα,8,13,13-tetramethyl-7,11β-methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-4α,5β,6α,9β,11α,12β,12bβ-heptol 4,5,6,9,12,12b-hexaacetate

IUPAC Name

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

Molecular Weight

652.70

Molecular Formula

C32H44O14

Canonical SMILES

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

InChI

InChI=1S/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(45-19(6)37)26-30(10,22(42-16(3)34)11-23-31(26,13-40-23)46-20(7)38)27(44-18(5)36)25(43-17(4)35)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23+,25+,26-,27-,28-,30+,31-,32+/m0/s1

InChIKey

CCJGGIKEFAWREN-WBPIOOJSSA-N

Purity

97.5%

Appearance

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Color

Yellow

Form

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