Wilforgine

[(1S,3R,18S,19R,20R,21R,22S,23R,24R,25R)-20,22,23,25-tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] furan-3-carboxylate

Also Known As: Wilforgine|4-27-00-06847 (Beilstein Handbook Reference)|[(1S,3R,18S,19R,20R,21R,22S,23R,24R,25R)-20,22,23,25-tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] furan-3-carboxylate|cent-Acetoxy-O2-(furan-3-carbonyl)-O2-deacetyl-8-deoxo-evonimine|Evonimine, 8-(acetyloxy)-O(sup 2)-deacetyl-8-deoxo-O(sup 2)-(3-furanylcarbonyl)-, (8-alpha)-|[tetraacetoxy-(acetoxymethyl)-hydroxy-trimethyl-dioxo-[?]yl] furan-3-carboxylate|(1S,3R,18S,19R,20R,21R,22S,23R,24R,25R)-20,22,23,25-tetrakis(acetyloxy)-21-[(acetyloxy)methyl]-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0(1),(2)(1).0(3),(2)?.0?,(1)(2)]hexacosa-7,9,11-trien-19-yl furan-3-carboxylate|(1S,3R,18S,19R,20R,21R,22S,23R,24R,25R)-20,22,23,25-Tetrakis(acetyloxy)-21-[(acetyloxy)methyl]-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0~1,21~.0~3,24~.0~7,12~]hexacosa-7,9,11-trien-19-yl furan-3-carboxylate

Molecular Formula	C41H47NO19
Molecular Weight	857.27423 g/mol
LogP	1.2
Topological Polar Surface Area	266.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	20
Rotatable Bonds	14
Exact Mass	857.27423
Monoisotopic Mass	857.27423
Heavy Atoms	61
Complexity	1790.0

Chemical Identifiers

CAS Number	37239-47-7
SMILES	CC1CCC2=C(C=CC=N2)C(=O)OC[C@]3([C@@H]4[C@H]([C@H]([C@@]5([C@H]([C@H]([C@@H](C([C@]5([C@@H]4OC(=O)C)O3)(C)O)OC1=O)OC(=O)C6=COC=C6)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)C
InChIKey	QFIYSPKZWOALMZ-YHQLYFKISA-N