CAS Number
Molecular Formula
C72H99N17O25
Product format
Neat
Molecular Weight
1602.68
Storage
-20°C
Shipping
Room Temperature
API Family
Synonyms
(3S)-3-((R)-4-amino-2-((S)-2-decanamido-3-(1H-indol-3-yl) propanamido) -4-oxobutanamido)-4-(((5R, 8S, 11S, 14R, 15S, 21S, 24S, 27R, 30S)-11-(2-(2-aminophenyl)-2-oxoethyl)-21-(3-aminopropyl)-24-(carboxymethyl)-8-((R)-1-carboxypropan-2-yl)-5-(hydroxymethyl)-14, 27-dimethyl-3, 6, 9, 12, 16, 19, 22, 25, 28, 32, 33-undecaoxo-13-oxa-1, 4, 7, 10, 17, 20, 23, 26 and 29-nonaazabicyclo[28.2.1]tritriacontan-15-yl)amino)-4-oxobutanoic acid
Iupac Name
(3S)-3-[[(2S)-4-amino-2-[[(2S)-2-(decanoylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-[[(5R, 8S, 11S, 14R, 15S, 21S, 24S, 27R, 30S)-11-[2-(2-aminophenyl)-2-oxoethyl]-21-(3-aminopropyl)-24-(carboxymethyl)-8-[(2R)-1-carboxypropan-2-yl]-5-(hydroxymethyl)-14, 27-dimethyl-3, 6, 9, 12, 16, 19, 22, 25, 28, 32, 33-undecaoxo-13-oxa-1, 4, 7, 10, 17, 20, 23, 26 and 29-nonazabicyclo[28.2.1]tritriacontan-15-yl]amino]-4-oxobutanoic acid
InChI
InChI=1S/C72H99N17O25/c1-5-6-7-8-9-10-11-22-53(93)80-44(25-38-31-76-42-20-15-13-17-39(38)42)65(106)82-45(27-52(75)92)66(107)84-47(30-59(101)102)67(108)88-61-37(4)114-72(113)49(26-51(91)40-18-12-14-19-41(40)74)86-70(111)60(35(2)24-57(97)98)87-68(109)50(34-90)81-55(95)33-89-56(96)28-48(71(89)112)85-62(103)36(3)78-64(105)46(29-58(99)100)83-63(104)43(21-16-23-73)79-54(94)32-77-69(61)110/h12-15,17-20,31,35-37,43-50,60-61,76,90H,5-11,16,21-30,32-34,73-74H2,1-4H3,(H2,75,92)(H,77,110)(H,78,105)(H,79,94)(H,80,93)(H,81,95)(H,82,106)(H,83,104)(H,84,107)(H,85,103)(H,86,111)(H,87,109)(H,88,108)(H,97,98)(H,99,100)(H,101,102)/t35-,36-,37-,43+,44+,45+,46+,47+,48+,49+,50-,60+,61+/m1/s1
