Limonin

(1R,2R,7S,10R,13R,14R,19S,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione

Also Known As: Limonin|Dictamnolactone|Citrolimonin|Obaculactone|Limonine|Evodin|Citro|Evodia fruit|AC1L22IY|Limonoic acid, di-delta-lactone|7,16-Dioxo-7,16-dideoxylimondiol|AN-8399|AI3-37932|11H,13H-Oxireno(d)pyrano(4',3':3,3a)isobenzofuro(5,4-f)(2)benzopyran-4,6,13(2H,5aH)-trione, 8-(3-furanyl)decahydro-2,2,4a,8a-tetramethyl-, (2aR,4aR,4bR,5aS,8S,8aS,10aR,10bR,14aS)-|11H,13H-Oxireno(d)pyrano(4',3':3,3a)isobenzofuro(5,4-f)(2)benzopyran-4,6,13(2H,5aH)-trione, 8-(3-furanyl)decahydro-2,2,4a,8a-tetramethyl-, (2aR-(2aalpha,4abeta,4bR,5aalpha,8alpha,8aalpha,10aalpha,10bR*,14aalpha))-|11H,13H-Oxireno(d)pyrano(4',3':3,3a)isobenzofuro(5,4-f)(2)benzopyran-4,6,13(2H,5aH)-trione, 8-(3-furyl)decahydro-2,2,4a,8a-tetramethyl-

Molecular Formula	C26H30O8
Molecular Weight	470.19406 g/mol
LogP	3.14
Topological Polar Surface Area	104.57 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	1
Exact Mass	470.19406
Heavy Atoms	34
Complexity	1123.8

Chemical Identifiers

CAS Number	1180-71-8
SMILES	C[C@@]12CC[C@H]3[C@]([C@@]14C(O4)C(=O)O[C@H]2C5=COC=C5)(C(=O)C[C@@H]6[C@@]37COC(=O)C[C@@H]7OC6(C)C)C