Lenoremycin

(E,2S,4R,8S)-8-[(2S,5R,6R,7R,9S)-2-[(2R,4S,5R,6R,9R)-2-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-4,6-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-7-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-2,6-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonon-6-enoic acid

Also Known As: Lenoremycin|Antibiotic A 130A|Antibiotic A-130A|Lenoremycin sodium salt|A-130A|Antibiotic Ro 21 6150|A 130C|A 130|Ro-21-6150|A-130|J3.615.028I|(11(2R,5S,6R),12R)-10-Demethyl-19-de((tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)oxy)-12-methyl-11-O-(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)dianemycin|(2S,4R,8S,E)-8-((2S,2'R,4'S,5R,5'R,7S,7'R,9R,10R,10'R)-2'-((2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyltetrahydro-2H-pyran-2-yl)-9-(((2R,5S,6R)-5-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-2,4',10,10'-tetramethyl-1,1',6,6'-tetraoxa[2,7'-bispiro[4.5]decan]-7-yl)-2,4,6-trimethyl-5-oxonon-6-enoic acid|(E,2S,4R,8S)-8-[(2S,5R,6R,7R,9S)-2-[(2R,4S,5R,6R,9R)-2-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-4,6-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-7-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-2,6-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonon-6-enoic acid|Dianemycin, 10-demethyl-19-de((tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)oxy)-12-methyl-11-O-(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)-, (11R(2R,5S,6R),12R)|(2S,4R,6E,8S)-8-[(2S,5R,7S,9R,10R)-2-[(2R,4S,5R,7R,10R)-2-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-4,10-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-9-{[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy}-2,10-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,4,6-trimethyl-5-oxonon-6-enoic acid|(2S,4R,6E,8S)-8-[(4'S,5R,5'R,7S,7'R,9R,10R,10'R)-2'-[(3S,5R,6R)-6-Hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-9-{[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy}-2,4',10,10'-tetramethyl[1,1',6,6'-tetraoxa-2,7'-bi(spiro[4.5]decan)]-7-yl]-2,4,6-trimethyl-5-oxonon-6-enoic acid|(E,2S,4R,8S)-8-((2S,5R,6R,7R,9S)-2-((2R,4S,5R,6R,9R)-2-((2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl)-4,6-dimethyl-1,10-dioxaspiro(4.5)decan-9-yl)-7-((2R,5S,6R)-5-methoxy-6-methyloxan-2-yl)oxy-2,6-dimethyl-1,10-dioxaspiro(4.5)decan-9-yl)-2,4,6-trimethyl-5-oxonon-6-enoic acid|(E,2S,4R,8S)-8-[(2S,5R,7S,9R,10R)-2-[(2R,4S,5R,7R,10R)-2-[(2S,3S,5R,6R)-6-Hydroxy-6-(hydroxymethyl)-3,5-dimethyltetrahydro-2H-pyran-2-yl]-4,10-dimethyl-1,6-dioxaspiro[4.5]decane-7-yl]-9-[(2R,5S,6R)-5-methoxy-6-methyltetrahydro-2H-pyran-2-yl]oxy-2,10-dimethyl-1,6-dioxaspiro[4.5]decane-7-yl]-2,4,6-trimethyl-5-oxo-6-nonenoic acid|(E,2S,4R,8S)-8-[(3S,5R,6R,7R,9S)-3-[(1S,3R,5R,6R,9R)-3-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-1,6-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-7-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-3,6-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]-2,4,6-trimethyl-5-oxonon-6-enoic acid|3-ETHYL-2-(3-ETHYL-4,5-DIPHENYL-THIAZOLIUM-2-YL-METHYLENE)-5-[2-(1-ETHYL-1H-QUINOLIN-4-YLIDENE)-ETHYLIDENE]-THIAZOLIDIN-4-ONE BROMIDE

Molecular Formula	C47H78O13
Molecular Weight	850.54425 g/mol
LogP	7.1788
Topological Polar Surface Area	168.67 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	12
Rotatable Bonds	13
Exact Mass	850.54425
Monoisotopic Mass	850.54425
Heavy Atoms	60
Complexity	1539.6024

Chemical Identifiers

CAS Number	51257-84-2
SMILES	C[C@@H]1CC[C@@H](O[C@@]12[C@H](C[C@@H](O2)[C@@H]3[C@H](C[C@H]([C@@](O3)(CO)O)C)C)C)[C@@]4(CC[C@@]5(O4)[C@@H]([C@@H](C[C@H](O5)[C@@H](C)/C=C(\C)/C(=O)[C@H](C)C[C@H](C)C(=O)O)O[C@H]6CC[C@@H]([C@H](O6)C)OC)C)C