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114586-21-9 bruceanol c

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Product Name bruceanol C
CAS No. 114586-21-9
Synonyms Bruceanol C; Picras-3-en-21-oic acid, 15-((4-(acetyloxy)-3,4-dimethyl-1-oxo-2-pentenyl)oxy)-13,20-epoxy-1,11,12-trihydroxy-2,16-dioxo-, methyl ester, (1beta,11beta,12alpha,15beta(E))-; methyl (1beta,8xi,11beta,12alpha,15beta)-15-[(3E)-5-(acetyloxy)-4,5-dimethyl-2-oxohex-3-enoyl]-1,11,12-trihydroxy-2,16-dioxo-13,20-epoxypicras-3-en-21-oate
InChI InChI=1/C31H38O13/c1-12-8-17(34)24(37)29(6)15(12)10-18-30-11-42-31(27(40)41-7,25(38)21(36)23(29)30)22(30)19(26(39)43-18)20(35)16(33)9-13(2)28(4,5)44-14(3)32/h8-9,15,18-19,21-25,36-38H,10-11H2,1-7H3/b13-9+/t15-,18+,19+,21+,22+,23+,24+,25-,29-,30?,31+/m0/s1
Molecular Formula C31H38O13
Molecular Weight 618.6256
Density 1.43g/cm3
Boiling point 815.9°C at 760 mmHg
Flash point 261.7°C
Refractive index 1.597