Moyukamycin

(2S,3E,6E,8S)-8-[(2S,7S,8R,9R)-7-hydroxy-2-[(2R,4S,6S,9R)-2-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-6-[[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxymethyl]-4-methyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonona-3,6-dienoic acid

Also Known As: Moyukamycin|(2S,3E,6E,8S)-8-[(3S,7S,8R,9R)-7-hydroxy-3-[(1S,3R,6S,9R)-3-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-6-[[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxymethyl]-1-methyl-4,10-dioxaspiro[4.5]decan-9-yl]-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonona-3,6-dienoic acid|Dianemycin, 3,4-didehydro-30-deoxy-19-de((tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)oxy)-37-((tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)oxy)-, (3E,37(2R,5S,6R))-

Molecular Formula	C47H76O13
Molecular Weight	848.52856 g/mol
LogP	7.0989
Topological Polar Surface Area	168.67 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	12
Rotatable Bonds	12
Exact Mass	848.52856
Monoisotopic Mass	848.52856
Heavy Atoms	60
Complexity	1595.7047

Chemical Identifiers

CAS Number	96827-80-4
SMILES	C[C@H]1C[C@H]([C@@](O[C@@H]1[C@H]2C[C@@H](C3(O2)[C@@H](CC[C@@H](O3)[C@@]4(CCC5(O4)C[C@@H]([C@H]([C@H](O5)[C@@H](C)/C=C(\C)/C(=O)/C(=C/[C@H](C)C(=O)O)/C)C)O)C)CO[C@H]6CC[C@@H]([C@H](O6)C)OC)C)(C)O)C