Onitisin 2'-O-glucoside

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$519	In stock

Category

Sesquiterpene

Cat.No.

NP5736

CAS

62043-53-2

Product Name

Onitisin 2'-O-glucoside

Structure

Product Details

Description

Onitisin 2'-O-glucoside is a natural sesquiterpenoid found in the herbs of Onychium japonicum.

Synonyms

Onitisin 2'-O-glucoside

IUPAC Name

(2S)-4-hydroxy-2-(hydroxymethyl)-2,5,7-trimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one

Molecular Weight

426.5

Molecular Formula

C21H30O9

Canonical SMILES

CC1=C(C(=C(C2=C1C(=O)C(C2)(C)CO)O)C)CCOC3C(C(C(C(O3)CO)O)O)O

InChI

InChI=1S/C21H30O9/c1-9-11(4-5-29-20-18(27)17(26)16(25)13(7-22)30-20)10(2)15(24)12-6-21(3,8-23)19(28)14(9)12/h13,16-18,20,22-27H,4-8H2,1-3H3/t13-,16-,17+,18-,20-,21+/m1/s1

InChIKey

CHKURBWNBQWBGM-VXYBAJBHSA-N

Boiling Point

707.4±60.0 °C(Predicted)

Purity

>98%

Density

1.45±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

9.69±0.40(Predicted)

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