Isorugosin D
[CAS# 95457-27-5]

Identification

• Name: Isorugosin D
• Synonyms: Isorugosin D; .Beta.-D-Glucopyranose, Cyclic 4.Fwdarw.2:6.Fwdarw.2'-[(1S)-4-[6-[[[4,6-O-[[(1S)-4,4',5,5',6,6'-Hexahydroxy[1,1'-Biphenyl]-2,2'-Diyl]Dicarbonyl]-2,3-Bis-O-(3,4,5-Trihydroxybenzoyl)-.Beta.-D-Glucopyranosyl]Oxy]Carbonyl]-2,3,4-Trihydroxyphenoxy
• Molecular Formula: C₈₂H₅₈O₅₂
• Molecular Weight: 1875.33
• CAS Registry Number: 95457-27-5
• SMILES: C1=C(C(=C(C3=C1C(OC2C(C(C(OC2COC(C4=CC(=C(C(=C34)O)O)O)=O)OC(C5=CC(=C(C(=C5O)O)O)O)=O)OC(C6=CC(=C(C(=C6)O)O)O)=O)OC(C7=CC(=C(C(=C7)O)O)O)=O)=O)O)O)OC8=C(C(=C(C=C8C(OC%11C(C(C%10OC(C%12=C(C9=C(C(=CC=C9C(OCC%10O%11)=O)O)O)C(=C(C(=C%12)O)O)O)=O)OC(C%13=CC(=C
• InChI: 1S/C82H58O52/c83-28-2-1-22-44(53(28)101)46-24(12-38(93)55(103)60(46)108)77(118)127-65-42(16-122-75(22)116)126-82(70(132-74(115)21-9-35(90)52(100)36(91)10-21)67(65)129-71(112)18-3-29(84)49(97)30(85)4-18)134-80(121)27-14-40(95)57(105)63(111)64(27)124-41-15-
• InChIKey: RRKSLFYXWXKOPJ-UHFFFAOYSA-N

Properties

• Density: 2.23g/cm³ (Cal.)