16-Deoxysaikogenin F

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For Research Use Only.

Category

Terpenes

Cat.No.

NP6450

CAS

57475-62-4

Product Name

16-Deoxysaikogenin F

Structure

Product Details

Description

16-Deoxysaikogenin F is a natural compound isolated from the roots of Bupleurum chinense.

Synonyms

57475-62-4; 16-Deoxysaikogenin F; (1S,4S,5R,8R,9R,10S,13S,14R,17S,18R)-9-(Hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-ol; AKOS032962621

IUPAC Name

(1S,4S,5R,8R,9R,10S,13S,14R,17S,18R)-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-ol

Molecular Weight

456.711

Molecular Formula

C30H48O3

Canonical SMILES

CC1(CCC23CCC4(C5(CCC6C(C5C=CC4(C2C1)OC3)(CCC(C6(C)CO)O)C)C)C)C

InChI

InChI=1S/C30H48O3/c1-24(2)13-15-29-16-14-28(6)27(5)11-7-20-25(3,10-9-23(32)26(20,4)18-31)21(27)8-12-30(28,33-19-29)22(29)17-24/h8,12,20-23,31-32H,7,9-11,13-19H2,1-6H3/t20-,21-,22-,23+,25+,26+,27-,28+,29-,30+/m1/s1

InChIKey

AXHYCHLBHJUCPN-TYFPGHAOSA-N

Boiling Point

552.0±50.0 °C(Predicted)

Density

1.12±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

14.90±0.70(Predicted)

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