Melleolide K

[(2R,2aS,4aS,7aS,7bR)-3-formyl-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 3-chloro-4,6-dihydroxy-2-methylbenzoate

Also Known As: Melleolide K|Melleolide-K|J1.291.510A|((2R,2aS,4aS,7aS,7bR)-3-formyl-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta(e)inden-2-yl) 3-chloro-4,6-dihydroxy-2-methylbenzoate|(2R,2aS,4aS,7aS,7bR)-3-formyl-2a-hydroxy-6,6,7b-trimethyl-1H,2H,2aH,4aH,5H,6H,7H,7aH,7bH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoate|[(2R,2As,4aS,7aS,7bR)-3-formyl-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 3-chloro-4,6-dihydroxy-2-methylbenzoate|[(2R,2aS,4aS,7aS,7bR)-3-ormyl-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 3-chloro-4,6-dihydroxy-2-methylbenzoate|2-Methyl-3-chloro-4,6-dihydroxybenzoic acid (2R)-2aalpha-hydroxy-3-formyl-6,6,7balpha-trimethyl-2,2a,4abeta,5,6,7,7abeta,7b-octahydro-1H-cyclobuta[e]indene-2-yl ester

Molecular Formula	C23H27ClO6
Molecular Weight	434.14963 g/mol
LogP	3.91742
Topological Polar Surface Area	104.06 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	434.14963
Monoisotopic Mass	434.14963
Heavy Atoms	30
Complexity	982.3957

Chemical Identifiers

CAS Number	264229-80-3
SMILES	CC1=C(C(=CC(=C1Cl)O)O)C(=O)O[C@@H]2C[C@]3([C@@]2(C(=C[C@H]4[C@@H]3CC(C4)(C)C)C=O)O)C