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Antibiotic UK 58852 (101621-29-8)

Identification
Name:Antibiotic UK 58852
Synonyms:Semduramicin,5-O-(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)-, [5(2S,5S,6R)]-;1,6-Dioxaspiro[4.5]decane, semduramicin deriv.; 2H-Pyran-2-acetic acid,tetrahydro-2-hydroxy-6-[1-[9-hydroxy-2,8-dimethyl-2-[octahydro-2-methyl-5'-(tetrahydro-6-hydroxy-3,5,6-trimethyl-2H-pyran-2-yl)-3'-[(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)oxy][2,2'-bifuran]-5-yl]-1,6-dioxaspiro[4.5]dec-7-yl]ethyl]-5-methoxy-3-methyl-4-[(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)oxy]-,[2R-[2a,3a,4b(2S*,5S*,6R*),5a,6b[R*[2S*[2S*,2'R*,3'S*(2S*,5S*,6R*),5R*,5'R*(2S*,3S*,5R*,6S*)],5R*,7S*,8R*,9S*]]]]-;Antibiotic UK 58852;2H-Pyran-2-acetic acid,tetrahydro-2-hydroxy-6-[(1R)-1-[(2S,5R,7S,8R,9S)-9-hydroxy-2,8-dimethyl-2-[(2S,2'R,3'S,5R,5'R)-octahydro-2-methyl-5'-[(2S,3S,5R,6S)-tetrahydro-6-hydroxy-3,5,6-trimethyl-2H-pyran-2-yl]-3'-[[(2S,5S,6R)-tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl]oxy][2,2'-bifuran]-5-yl]-1,6-dioxaspiro[4.5]dec-7-yl]ethyl]-5-methoxy-3-methyl-4-[[(2S,5S,6R)-tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl]oxy]-,(2R,3S,4S,5R,6S)- (9CI)
CAS:101621-29-8
Molecular Formula: C52H88 O18
Molecular Weight: 1001.2443
InChI: InChI=1/C52H88O18/c1-26-22-27(2)50(10,56)67-42(26)36-23-37(63-40-16-14-34(58-11)31(6)61-40)47(64-36)49(9)19-18-38(66-49)48(8)20-21-51(70-48)24-33(53)28(3)43(68-51)29(4)44-46(60-13)45(30(5)52(57,69-44)25-39(54)55)65-41-17-15-35(59-12)32(7)62-41/h26-38,40-47,53,56-57H,14-25H2,1-13H3,(H,54,55)/t26-,27+,28+,29+,30-,31+,32+,33-,34-,35-,36?,37-,38+,40-,41-,42-,43-,44-,45-,46-,47+,48-,49-,50-,51?,52+/m0/s1
Molecular Structure: (C52H88O18) Semduramicin,5-O-(tetrahydro-5-methoxy-6-methyl-2H-pyran-2-yl)-, [5(2S,5S,6R)]-;1,6-Dioxaspiro[4.5]d...
Properties
Flash Point: 264.4°C
Boiling Point: 967.2°C at 760 mmHg
Density:1.25g/cm3
Refractive index:1.551
Flash Point: 264.4°C
Safety Data
 

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