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64925-80-0 phomopsin a

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Product Name phomopsin A
CAS No. 64925-80-0
Synonyms Phomopsin A; (2Z)-[(3Z)-9-[(3-chloro-4,5-dihydroxyphenyl)(hydroxy)methyl]-15-(1-hydroxy-1-methylpropyl)-8-methyl-12-(1-methylethenyl)-3-(1-methylpropylidene)-1,4,7,10,13,16-hexaoxo-2,3,4,5,7,8,9,10,11,12,13,14,15,16,18,20a-hexadecahydropyrrolo[1,2-a][1,4,7,10,13,16]hexaazacyclooctadecin-6(1H)-ylidene]ethanoic acid
InChI InChI=1/C36H45ClN6O12/c1-8-17(5)25-32(51)38-20(15-23(45)46)34(53)42(7)26(27(47)18-13-19(37)28(48)22(44)14-18)33(52)39-24(16(3)4)31(50)41-29(36(6,55)9-2)35(54)43-12-10-11-21(43)30(49)40-25/h10-11,13-15,21,24,26-27,29,44,47-48,55H,3,8-9,12H2,1-2,4-7H3,(H,38,51)(H,39,52)(H,40,49)(H,41,50)(H,45,46)/b20-15-,25-17-
Molecular Formula C36H45ClN6O12
Molecular Weight 789.2285
Density 1.48g/cm3
Boiling point 1188.2°C at 760 mmHg
Flash point 672.4°C
Refractive index 1.655