1-O-Deacetylkhayanolide E

Inquiry

For Research Use Only.

Category

Terpenes

Cat.No.

NP6751

CAS

1007387-95-2

Product Name

1-O-Deacetylkhayanolide E

Structure

Product Details

Description

1-O-Deacetylkhayanolide E isolated from the herbs of Khaya senegalensis.

Synonyms

Deacetylkhayanolide E; Methyl (2S)-[(1R,2S,3S,4R,7S,8R,12R,14R,16R,17R,18S)-8-(3-furyl)-1,3-dihydroxy-7,16,18-trimethyl-10,15-dioxo-9,13-dioxahexacyclo[14.2.1.02,14.03,12.04,18.07,12]nonadec-17-yl](hydroxy)acetate

IUPAC Name

methyl (2S)-2-[(1S,2S,3S,4R,7S,8S,12R,14R,16R,17R,18S)-8-(furan-3-yl)-1,3-dihydroxy-7,16,18-trimethyl-10,15-dioxo-9,13-dioxahexacyclo[14.2.1.02,14.03,12.04,18.07,12]nonadecan-17-yl]-2-hydroxyacetate

Molecular Weight

516.6

Molecular Formula

C27H32O10

Canonical SMILES

CC12CCC3C4(C(C5(CC4(C6C3(C1(CC(=O)OC2C7=COC=C7)OC6C5=O)O)O)C)C(C(=O)OC)O)C

InChI

InChI=1S/C27H32O10/c1-22-11-25(32)18-16(19(22)30)37-26-9-14(28)36-20(12-6-8-35-10-12)23(26,2)7-5-13(27(18,26)33)24(25,3)17(22)15(29)21(31)34-4/h6,8,10,13,15-18,20,29,32-33H,5,7,9,11H2,1-4H3/t13-,15+,16-,17+,18+,20+,22-,23+,24-,25+,26-,27+/m1/s1

Purity

95.5%

Appearance

Powder

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