Isodonine

(1S,4S,6S,8R,9S,12S,13S,16R)-6,9-dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione

Also Known As: Isodonin|Isodonine|Enmein|Sculponeatin D|dihydroxy-dimethyl-methylene-[?]dione|4-18-00-03114 (Beilstein Handbook Reference)|5H-5a,8-Methano-11H-cyclohepta(c)furo(3,4-e)(1)benzopyran-5,6(7H)-dione, decahydro-2,13-dihydroxy-1,1-dimethyl-7-methylene-, (2S,3as,5as,7R,8R,10aS,10bS,13R,13aR)-|5H-5a,8-Methano-11H-cyclohepta[c]furo[3,4-e][1]benzopyran-5,6(7H)-dione, decahydro-2,13-dihydroxy-1,1-dimethyl-7-methylene-, (2S,3aS,5aS,8R,10aS,10bS,13S,13aR)-

Molecular Formula	C20H26O6
Molecular Weight	362.17294 g/mol
LogP	1.2
Topological Polar Surface Area	93.06 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	0
Exact Mass	362.17294
Heavy Atoms	26
Complexity	727.8

Chemical Identifiers

CAS Number	3776-39-4
SMILES	CC1([C@H](C[C@H]2[C@]3([C@@H]1[C@H](OC3)O)[C@@H]4CC[C@@H]5C[C@]4(C(=O)C5=C)C(=O)O2)O)C