Milbemycin B, 25-(1-methylethyl)-, (25R)- structure

Milbemycin B, 25-(1-methylethyl)-, (25R)-

(1S,4R,5'S,6'R,7S,9S,10E,12E,14R,16E,19R,21R)-9-hydroxy-10-(hydroxymethyl)-7-methoxy-5',6,14,16-tetramethyl-6'-propan-2-ylspiro[2,20-dioxatricyclo[17.3.1.04,9]tricosa-5,10,12,16-tetraene-21,2'-oxane]-3-one

Also Known As: Milbemycin E|(25R)-25-Isopropylmilbemycin B|Milbemycin B, 25-(1-methylethyl)-, (25R)-|(1'S,2R,4'R,5S,6R,7'S,9'S,10'E,12'E,14'R,19'R)-9'-hydroxy-10'-(hydroxymethyl)-7'-methoxy-5,6',14',16'-tetramethyl-6-(propan-2-yl)-2',20'-dioxaspiro[oxane-2,21'-tricyclo[17.3.1.04,9]tricosane]-5',10',12',16'-tetraen-3'-one

CAS: 83204-48-2
Molecular Formula C34H52O7
Molecular Weight 572.3713 g/mol
LogP 5.808
Topological Polar Surface Area 94.45 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 3
Exact Mass 572.3713
Monoisotopic Mass 572.3713
Heavy Atoms 41
Complexity 1057.291

Chemical Identifiers

CAS Number 83204-48-2
SMILES C[C@H]1CC[C@]2(C[C@@H]3C[C@H](O2)C/C=C(/C[C@H](/C=C/C=C(/[C@@]4(C[C@@H](C(=C[C@H]4C(=O)O3)C)OC)O)\CO)C)\C)O[C@@H]1C(C)C

Product Overview

Milbemycin B, 25-(1-methylethyl)-, (25R)- (CAS 83204-48-2), with molecular formula C34H52O7 and molecular weight 572.3713 g/mol. IUPAC: (1S,4R,5'S,6'R,7S,9S,10E,12E,14R,16E,19R,21R)-9-hydroxy-10-(hydroxymethyl)-7-methoxy-5',6,14,16-tetramethyl-6'-propan-2-ylspiro[2,20-dioxatricyclo[17.3.1.04,9]tricosa-5,10,12,16-tetraene-21,2'-oxane]-3-one.

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