Ledol, Antifungal agent

Key facts

CAS number

577-27-5

Purity

>95%

Form

Solid

form

Source

Ledum palustre

Molecular weight

222.37 Da

Molecular formula

C₁₅H₂₆O

PubChem

92812

Nature

Native

Solubility

Soluble in ethanol

Soluble in DMSO

Biochemical name

Ledol

Biological description

Antifungal agent. Putative anti-inflammatory and antinociceptive agent. May show expectorant, anti-inflammatory, antitussive and antinociceptive effects in vivo. Orally active.

Canonical smiles

CC1CCC2C1C3C(C3(C)C)CCC2(C)O

Isomeric smiles

C[C@@H]1CC[C@H]2[C@@H]1[C@H]3[C@H](C3(C)C)CC[C@@]2(C)O

InChi

InChI=1S/C15H26O/c1-9-5-6-10-12(9)13-11(14(13,2)3)7-8-15(10,4)16/h9-13,16H,5-8H2,1-4H3/t9-,10+,11-,12-,13-,15-/m1/s1

InChiKey

AYXPYQRXGNDJFU-AOWZIMASSA-N

IUPAC Name

(1aR,4R,4aS,7R,7aS,7bS)-1,1,4,7-tetramethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulen-4-ol