Reneilmol

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For Research Use Only.

Category

Sesquiterpene

Cat.No.

NP5720

CAS

260968-11-4

Product Name

Reneilmol

Structure

Description

Reneilmol is isolated from Plumeria obtusa.

Synonyms

6,7,10-Isodaucanetriol; (3S,3aS,4R,5S,8R,8aR)-5,8a-dimethyl-3-propan-2-yl-1,2,3,3a,4,6,7,8-octahydroazulene-4,5,8-triol

IUPAC Name

(3S,3aS,4R,5S,8R,8aR)-5,8a-dimethyl-3-propan-2-yl-1,2,3,3a,4,6,7,8-octahydroazulene-4,5,8-triol

Molecular Weight

256.386

Molecular Formula

C15H28O3

Canonical SMILES

CC(C)C1CCC2(C1C(C(CCC2O)(C)O)O)C

InChI

InChI=1S/C15H28O3/c1-9(2)10-5-7-14(3)11(16)6-8-15(4,18)13(17)12(10)14/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12+,13+,14-,15-/m0/s1

InChIKey

XUVQJFBJHKRROA-ZYIYBEKCSA-N

Boiling Point

359.9±32.0 °C(Predicted)

Density

1.092±0.06 g/cm3(Predicted)

Appearance

Powder

pKa

14.38±0.70(Predicted)

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