Tomenphantin B structure

Tomenphantin B

[(1S,2S,4R,7Z,10S,11R)-8-formyl-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-10-yl] 2-methylprop-2-enoate

Also Known As: tomenphantin B|J1.062.329D|[(1S,2S,4R,7Z,10S,11R)-8-formyl-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-10-yl] 2-methylprop-2-enoate|2-Propenoic acid, 2-methyl-, (1aR,4Z,7S,7aR,10aS,10bR)-5-formyl- 1a,2,3,6,7,7a,8,9,10a,10b-decahydro-1a-methyl-8-methylene-9-oxooxireno(9,10)cyclodeca(1,2-b)furan-7-yl ester|((1S,2S,4R,7Z,10S,11R)-8-formyl-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo(9.3.0.02,4)tetradec-7-en-10-yl) 2-methylprop-2-enoate|(1S,2S,4R,7Z,10S,11R)-8-formyl-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-10-yl 2-methylprop-2-enoate|(3aR,4S,6Z,10R,11S,11aS)-10,11-Epoxy-2,3,3a,4,5,8,9,10,11,11a-decahydro-4-(methacryloyloxy)-10-methyl-3-methylene-2-oxocyclodeca[b]furan-6-carbaldehyde

CAS: 220114-45-4
Molecular Formula C19H22O6
Molecular Weight 346.14163 g/mol
LogP 2.0388
Topological Polar Surface Area 82.2 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 346.14163
Monoisotopic Mass 346.14163
Heavy Atoms 25
Complexity 690.0279

Chemical Identifiers

CAS Number 220114-45-4
SMILES CC(=C)C(=O)O[C@H]1C/C(=C/CC[C@@]2([C@@H](O2)[C@@H]3[C@@H]1C(=C)C(=O)O3)C)/C=O

Product Overview

Tomenphantin B (CAS 220114-45-4), with molecular formula C19H22O6 and molecular weight 346.14163 g/mol. IUPAC: [(1S,2S,4R,7Z,10S,11R)-8-formyl-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-10-yl] 2-methylprop-2-enoate.

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