Identification |
Name: | Acetonitrile,[(2S,3R,4S,6R)-2-hydroxy-6-[[2-O-[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]-b-D-glucopyranosyl]oxy]-3,4-dimethoxycyclohexylidene]-,(2Z)- |
Synonyms: | 2-Propenoicacid, 3-(4-hydroxy-3-methoxyphenyl)-, 2'-ester with [6-(b-D-glucopyranosyloxy)-2-hydroxy-3,4-dimethoxycyclohexylidene]acetonitrile,(1Z,2a,3b,4b,6b)-; Acetonitrile,[(2S,3R,4S,6R)-2-hydroxy-6-[[2-O-[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-b-D-glucopyranosyl]oxy]-3,4-dimethoxycyclohexylidene]-,(2Z)- (9CI); Acetonitrile,[2-hydroxy-6-[[2-O-[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-b-D-glucopyranosyl]oxy]-3,4-dimethoxycyclohexylidene]-,(1Z,2a,3b,4b,6b)-; Simmondsin 2'-ferulate |
CAS: | 67411-22-7 |
Molecular Formula: | C26H33 N O12 |
Molecular Weight: | 551.5397 |
InChI: | InChI=1/C26H33NO12/c1-34-17-10-13(4-6-15(17)29)5-7-20(30)39-25-23(33)22(32)19(12-28)38-26(25)37-16-11-18(35-2)24(36-3)21(31)14(16)8-9-27/h4-8,10,16,18-19,21-26,28-29,31-33H,11-12H2,1-3H3/b7-5-,14-8+/t16-,18+,19-,21+,22-,23+,24+,25-,26-/m1/s1 |
Molecular Structure: |
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Properties |
Flash Point: | 432.5°C |
Boiling Point: | 791.5°Cat760mmHg |
Density: | 1.44g/cm3 |
Refractive index: | 1.61 |
Flash Point: | 432.5°C |
Safety Data |
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