Tovophyllin B

10,22-dihydroxy-7,7,18,18-tetramethyl-11-(3-methylbut-2-enyl)-8,13,17-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(22),3,5,9,11,14,16(21),19-octaen-2-one

Also Known As: Tovophyllin B|Mangostenone B|Dulcisxanthone D|Nigrolineaxanthone W|J1.758.999G|dihydroxy-tetramethyl-(3-methylbut-2-enyl)[?]one|10,22-dihydroxy-7,7,18,18-tetramethyl-11-(3-methylbut-2-en-1-yl)-8,13,17-trioxapentacyclo[12.8.0.0^{3,12}.0^{4,9}.0^{16,21}]docosa-1(22),3,5,9,11,14,16(21),19-octaen-2-one|10,22-dihydroxy-7,7,18,18-tetramethyl-11-(3-methylbut-2-enyl)-8,13,17-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(22),3,5,9,11,14,16(21),19-octaen-2-one|10,22-dihydroxy-7,7,18,18-tetramethyl-11-(3-methylbut-2-en-1-yl)-8,13,17-trioxapentacyclo(12.8.0.0^(3,12).0^(4,9).0^(16,21))docosa-1(22),3,5,9,11,14,16(21),19-octaen-2-one|10,22-dihydroxy-7,7,18,18-tetramethyl-11-(3-methylbut-2-en-1-yl)-8,13,17-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(22),3,5,9,11,14,16(21),19-octaen-2-one|10,22-dihydroxy-7,7,18,18-tetramethyl-11-(3-methylbut-2-enyl)-8,13,17-trioxapentacyclo(12.8.0.03,12.04,9.016,21)docosa-1(22),3,5,9,11,14,16(21),19-octaen-2-one|10H-Dipyrano[2,3-i:3',2'-a]xanthen-14(3H)-one, 5,13-dihydroxy-3,3,10,10-tetramethyl-6-(3-methyl-2-butenyl)-|3,10-Dihydro-5,13-dihydroxy-3,3,10,10-tetramethyl-6-(3-methyl-2-butenyl)-14H-dipyrano[3,2-a:2 ,3 -i]xanthene-14-one|3,3,10,10-Tetramethyl-5,13-dihydroxy-6-(3-methyl-2-butenyl)-10H-4,7,9-trioxabenzo[a]naphthacene-14(3H)-one|3,3,10,10-Tetramethyl-5,13-dihydroxy-6-(3-methyl-2-butenyl)-3H,10H,14H-dipyrano[3,2-a:2 ,3 -i]xanthene-14-one|5,13-Dihydroxy-3,3,10,10-tetramethyl-6-(3-methyl-2-butenyl)-2H-dipyrano[2,3-a:2',3'-i]xanthen-14-one|5,13-Dihydroxy-3,3,10,10-tetramethyl-6-(3-methylbut-2-en-1-yl)-10H-dipyrano[3,2-a:2',3'-i]xanthen-14(3H)-one

Molecular Formula	C28H28O6
Molecular Weight	460.1886 g/mol
LogP	6.6
Topological Polar Surface Area	85.2 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	460.1886
Monoisotopic Mass	460.1886
Heavy Atoms	34
Complexity	912.0

Chemical Identifiers

CAS Number	40738-45-2
SMILES	CC(=CCC1=C2C(=C3C=CC(OC3=C1O)(C)C)C(=O)C4=C(C5=C(C=C4O2)OC(C=C5)(C)C)O)C
InChIKey	NKTLGMPGRFCLNF-UHFFFAOYSA-N