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128531-64-6 n-{[(2s,5r,8s,11s,14s,17s)-11-(4-aminobutyl)-8-(2-carboxyethyl)-2-[(1r)-1-hydroxyethyl]-

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Product Name N-{[(2S,5R,8S,11S,14S,17S)-11-(4-aminobutyl)-8-(2-carboxyethyl)-2-[(1R)-1-hydroxyethyl]-5,14-bis(hydroxymethyl)-3,6,9,12,15,20-hexaoxo-1,4,7,10,13,16-hexaazacycloicosan-17-yl]carbonyl}-L-threonyl-L-prolyl-L-leucyl-L-valyl-L-threonylleucine
CAS No. 128531-64-6
InChI InChI=1/C56H95N13O21/c1-25(2)21-34(48(81)66-41(27(5)6)52(85)67-43(29(8)73)54(87)62-35(56(89)90)22-26(3)4)61-51(84)38-14-12-20-69(38)55(88)44(30(9)74)68-47(80)32-15-17-39(75)65-42(28(7)72)53(86)64-37(24-71)50(83)60-33(16-18-40(76)77)46(79)58-31(13-10-11-19-57)45(78)63-36(23-70)49(82)59-32/h25-38,41-44,70-74H,10-24,57H2,1-9H3,(H,58,79)(H,59,82)(H,60,83)(H,61,84)(H,62,87)(H,63,78)(H,64,86)(H,65,75)(H,66,81)(H,67,85)(H,68,80)(H,76,77)(H,89,90)/t28-,29-,30-,31+,32+,33+,34+,35?,36+,37-,38+,41+,42+,43+,44+/m1/s1
Molecular Formula C56H95N13O21
Molecular Weight 1286.428
Density 1.256g/cm3
Boiling point 1716.2°C at 760 mmHg
Flash point 991.7°C
Refractive index 1.524