Amaralin

(1S,3R,7S,9R,10S,11R,13S,14R)-14-hydroxy-1,9-dimethyl-4-methylidene-6,12-dioxatetracyclo[8.4.0.03,7.011,13]tetradecan-5-one

Also Known As: Amaralin|Amaralin from helenium amarum|KST-1A0293|(1aR,1bS,2R,3aS,6aR,7aS,8R,8aS)-8-hydroxy-2,7a-dimethyl-6-methylidene-1a,1b,2,3,3a,6a,7,7a,8,8a-decahydrooxireno[1,2]azuleno[6,5-b]furan-5(6H)-one|(1ar,1bs,2r,3as,6ar,7as,8r,8as)-8-hydroxy-2,7a-dimethyl-6-methylidenedecahydrooxireno[1,2]azuleno[6,5-b]furan-5(1ah)-one|(1aR,1balpha,3abeta,6aalpha,8abeta)-1b,2,3,3a,6,6a,7,7a,8,8a-Decahydro-8beta-hydroxy-2alpha,7abeta-dimethyl-6-methyleneoxireno[1,2]azuleno[6,5-b]furan-5(1aH)-one|(1S,3R,7S,9R,10S,11R,13S,14R)-14-hydroxy-1,9-dimethyl-4-methylidene-6,12-dioxatetracyclo[8.4.0.03,7.011,13]tetradecan-5-one

Molecular Formula	C15H20O4
Molecular Weight	264.13617 g/mol
LogP	1.28
Topological Polar Surface Area	59.06 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	0
Exact Mass	264.13617
Heavy Atoms	19
Complexity	472.8

Chemical Identifiers

CAS Number	6831-10-3
SMILES	C[C@@H]1C[C@H]2[C@H](C[C@]3([C@H]1[C@@H]4[C@H]([C@@H]3O)O4)C)C(=C)C(=O)O2