Chemse

molweight: 1107.26348
molformula: C48H82N16O14
xlogp: 0
InChI=1S/C48H82N16O14/c1-24(2)22-34-44(73)57-28(10-16-49)38(67)56-31(13-19-52)42(71)63-36(25(3)65)46(75)54-21-15-33(41(70)55-29(11-17-50)40(69)61-35(45(74)60-34)23-27-8-6-5-7-9-27)58-39(68)30(12-18-51)59-47(76)37(26(4)66)64-43(72)32(14-20-53)62-48(77)78/h5-9,24-26,28-37,62,65-66H,10-23,49-53H2,1-4H3,(H,54,75)(H,55,70)(H,56,67)(H,57,73)(H,58,68)(H,59,76)(H,60,74)(H,61,69)(H,63,71)(H,64,72)(H,77,78)/t25-,26-,28+,29+,30+,31+,32+,33+,34+,35-,36+,37+/m1/s1
inchikey: WGRSQPZAOZIPGC-VVYZPAMCSA-N
iupac: [(2S)-4-azanyl-1-[[(2S,3R)-1-[[(2S)-4-azanyl-1-oxo-1-[[(1S,4S,7R,10S,13S,16S,19S)-4,13,16-tris(2-azanylethyl)-19-[(1R)-1-hydroxyethyl]-10-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-7-(phenylmethyl)-3,6,9,12,15,18,21-heptazacyclotricos-1-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxo-butan-2-yl]amino]-1-oxo-butan-2-yl]carbamic acid