Durantoside II

Inquiry

For Research Use Only.

Category

Iridoid derivatives

Cat.No.

NP3728

CAS

53526-66-2

Product Name

Durantoside II

Structure

Product Details

Description

Durantoside II is a natural iIridoid found in the herbs of Duranta repens.

Synonyms

Durantoside II

IUPAC Name

methyl (1S,4aR,6S,7R,7aS)-4a,7-dihydroxy-6-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate

Molecular Weight

582.56

Molecular Formula

C27H34O14

Canonical SMILES

CC1(C(CC2(C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O)OC(=O)C=CC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C27H34O14/c1-26(34)17(40-18(29)9-6-13-4-7-14(36-2)8-5-13)10-27(35)15(23(33)37-3)12-38-25(22(26)27)41-24-21(32)20(31)19(30)16(11-28)39-24/h4-9,12,16-17,19-22,24-25,28,30-32,34-35H,10-11H2,1-3H3/b9-6+/t16-,17+,19-,20+,21-,22-,24+,25+,26+,27+/m1/s1

Boiling Point

803.7±65.0°C (Predicted)

Purity

>95%

Density

1.52±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

11.18±0.70(Predicted)

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