Colartin

(3S,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one

Also Known As: Colartin|11,13-Dihydroarbusculin A|KST-1A3455|KST-1A3456|(3s,3as,5ar,9r,9as,9bs)-9-hydroxy-3,5a,9-trimethyldecahydronaphtho[1,2-b]furan-2(3h)-one|(3S,3aS,5aR,9R,9aS,9bS)-9-Hydroxy-3,5a,9-trimethyldecahydron|9-Hydroxy-3,5a,9-trimethyldecahydronaphtho[1,2-b]furan-2(3H)-one|(3S,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one|(3S)-3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-9beta-hydroxy-3beta,5aalpha,9-trimethylnaphtho[1,2-b]furan-2(3H)-one|(3S)-9beta-Hydroxy-3beta,5aalpha,9-trimethyl-3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-decahydronaphtho[1,2-b]furan-2(3H)-one|(3S,3AS,5AR,9R,9AS,9BS)-9-HYDROXY-3,5A,9-TRIMETHYL-DODECAHYDRONAPHTHO[1,2-B]FURAN-2-ONE|Naphtho(1,2-b)furan-2(3H)-one, decahydro-9-hydroxy-3,5a,9-trimethyl-, (3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta))-|Naphtho[1,2-b]furan-2(3H)-one,decahydro-9-hydroxy-3,5a,9-trimethyl-, (3S,3aS,5aR,9R,9aS,9bS)-

Molecular Formula	C15H24O3
Molecular Weight	252.17255 g/mol
LogP	2.9
Topological Polar Surface Area	46.5 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	252.17255
Monoisotopic Mass	252.17255
Heavy Atoms	18
Complexity	380.0

Chemical Identifiers

CAS Number	28443-69-8
SMILES	C[C@H]1[C@@H]2CC[C@]3(CCC[C@@]([C@@H]3[C@H]2OC1=O)(C)O)C
InChIKey	JVVPNUMNEHBXGD-WKKWAXIPSA-N