Coriamyrtione

(1R,2S,3R,5S,6S,7S,9R,12S)-2-hydroxy-7-methyl-12-prop-1-en-2-ylspiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-11-one

Also Known As: Coriamyrtione|Coriamyrtine|Tutin|KST-1A3291|(1ar,1bs,2r,5r,6as,7s,7as,8s)-1b-hydroxy-6a-methyl-8-(prop-1-en-2-yl)hexahydrospiro[2,5-methanooxireno[3,4]cyclopenta[1,2-d]oxepine-7,2'-oxiran]-3(2h)-one|(2S)-hydroxy-isopropenyl-methyl-spiro[[?]-2,2'-oxirane]one

Molecular Formula	C15H18O5
Molecular Weight	278.11542 g/mol
LogP	0.41
Topological Polar Surface Area	71.59 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	1
Exact Mass	278.11542
Heavy Atoms	20
Complexity	566.6

Chemical Identifiers

CAS Number	26430-98-8
SMILES	CC(=C)[C@H]1[C@H]2C[C@@]3([C@]4(CO4)[C@@H]5[C@H]([C@@]3([C@@H]1C(=O)O2)O)O5)C