6-Epiharpagoside

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For Research Use Only.

Category

Iridoid derivatives

Cat.No.

NP3912

CAS

1151862-67-7

Product Name

6-Epiharpagoside

Structure

Product Details

Description

6-Epiharpagoside isolated from the roots of Scrophularia ningpoensis Hemsl.

Synonyms

Curvifloruside F

IUPAC Name

[(1S,4aS,5S,7S,7aS)-4a,5-dihydroxy-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-7-yl] (E)-3-phenylprop-2-enoate

Molecular Weight

494.5

Molecular Formula

C24H30O11

Canonical SMILES

CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)OC(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C24H30O11/c1-23(35-16(27)8-7-13-5-3-2-4-6-13)11-15(26)24(31)9-10-32-22(20(23)24)34-21-19(30)18(29)17(28)14(12-25)33-21/h2-10,14-15,17-22,25-26,28-31H,11-12H2,1H3/b8-7+/t14-,15+,17-,18+,19-,20-,21+,22+,23+,24-/m1/s1

InChIKey

KVRQGMOSZKPBNS-PIMRTDLFSA-N

Boiling Point

720.7±60.0°C (Predicted)

Purity

> 95%

Density

1.52±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

11.70±0.70(Predicted)

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