Smyrindioloside

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For Research Use Only.

Category

Coumarins

Cat.No.

NP1155

CAS

87592-77-6

Product Name

Smyrindioloside

Structure

Product Details

Description

Smyrindioloside isolated from the roots of Heracleum stenopterum.

Synonyms

(3'R)-Hydroxymarmesin 4'-O-beta-D-glucopyranoside;1'-O-beta-D-Glucopyranosyl-3-hydroxynodakenetin; 2-[(2S,3R)-3-Hydroxy-7-oxo-2,3-dihydro-7H-furo[3,2-g]chromen-2-yl ]-2-propanyl β-D-glucopyranoside

IUPAC Name

(2S,3R)-3-hydroxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one

Molecular Weight

424.4

Molecular Formula

C20H24O10

Canonical SMILES

CC(C)(C1C(C2=C(O1)C=C3C(=C2)C=CC(=O)O3)O)OC4C(C(C(C(O4)CO)O)O)O

InChI

InChI=1S/C20H24O10/c1-20(2,30-19-17(26)16(25)15(24)12(7-21)29-19)18-14(23)9-5-8-3-4-13(22)27-10(8)6-11(9)28-18/h3-6,12,14-19,21,23-26H,7H2,1-2H3/t12-,14-,15-,16+,17-,18+,19+/m1/s1

InChIKey

KLPNFWKZLQAVTH-LDCXIIFCSA-N

Purity

0.955

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