Semialactone

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$519	In stock

Category

Terpenes

Cat.No.

NP6848

CAS

366450-46-6

Product Name

Semialactone

Structure

Product Details

Description

Semialactone isolated from the barks of Rhus javanica L.

Synonyms

(2S,3R,4S)-4-(2-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}et hyl)-2-(β-D-glucopyranosyloxy)-3-vinyl-3,4-dihydro-2H-pyran-5-car boxylic acid

IUPAC Name

(2S)-2-[1-[(1S,2S,5R,6S,9R,10R,13R,15S)-15-hydroxy-9,10,14,14-tetramethyl-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadecan-6-yl]ethenyl]-5-methyl-2,3-dihydropyran-6-one

Molecular Weight

468.7

Molecular Formula

C30H44O4

Canonical SMILES

CC1=CCC(OC1=O)C(=C)C2CCC3(C2CCC4C3(CCC5C46CCC(C5(C)C)(OC6)O)C)C

InChI

InChI=1S/C30H44O4/c1-18-7-9-22(34-25(18)31)19(2)20-11-13-27(5)21(20)8-10-24-28(27,6)14-12-23-26(3,4)30(32)16-15-29(23,24)17-33-30/h7,20-24,32H,2,8-17H2,1,3-6H3/t20-,21-,22+,23+,24+,27-,28-,29-,30+/m1/s1

InChIKey

GNMZYIRHZHRDGC-GJHSOGOJSA-N

Boiling Point

596.0±50.0 °C(Predicted)

Purity

95%

Density

1.15±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

13.22±0.70(Predicted)

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