Stellettin C

[(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-[(3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-7-yl] acetate

Also Known As: Stellettin C|Stelletin C|[(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-[(3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-7-yl] acetate|((3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-2-oxo-3-((3E,5E)-6-(6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene)-1,4,5,5a,7,8,9,9b-octahydrocyclopenta(a)naphthalen-7-yl) acetate|((3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-((3E,5E)-6-(5-methyl-6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene)-2-oxo-1,4,5,5a,7,8,9,9b-octahydrocyclopenta(a)naphthalen-7-yl) acetate|(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-3-[(3E,5E)-6-(3-methyl-2-oxo-2H-pyran-6-yl)hepta-3,5-dien-2-ylidene]-2-oxo-dodecahydro-1H-cyclopenta[a]naphthalen-7-yl acetate|(8alpha,9beta,13E,15E,17E,22Z,24Z)-22-Hydroxy-3beta-acetoxy-12-oxo-5alpha-malabarica-13,15,17(20),22,24-penten-26-oic acid lactone|[(3E,3aS,5aR,7S,9aR,9bS)-3a,6,6,9a-tetramethyl-2-oxo-3-[(3E,5E)-6-(6-oxopyran-2-yl)hepta-3,5-dien-2-ylidene]-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-7-yl] acetate

Molecular Formula	C32H42O5
Molecular Weight	506.30322 g/mol
LogP	6.98752
Topological Polar Surface Area	73.58 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	506.30322
Monoisotopic Mass	506.30322
Heavy Atoms	37
Complexity	1257.9658

Chemical Identifiers

CAS Number	184885-07-2
SMILES	CC1=CC=C(OC1=O)/C(=C/C=C/C(=C\2/C(=O)C[C@@H]3[C@@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)OC(=O)C)C)C)/C)/C