CAS Number
Molecular Formula
C58H66N10O9.2C4H7NO4
Product format
Neat
Molecular Weight
1047.23 2*133.10
API Family
Synonyms
Pasireotide diaspartate; UNII-I4P76SY3N4; I4P76SY3N4; Pasireotide (as diaspartate); 820232-50-6; Cyclo((2R)-2-phenylglycyl-d-tryptophyl-l-lysyl-o-(phenylmethyl)-l-tyrosyl-l-phenylalanyl-(4R)-4-((((2-aminoethyl)amino)carbonyl)oxy)-l-prolyl), l-aspartate (1:2); DTXSID40231533; RefChem:57496; DTXCID70154024; Signifor; Pasireotide diaspartate [EMA EPAR]; Pasireotide (diaspartate); (2S)-2-aminobutanedioic acid;[(3S, 6S, 9S, 12R, 15S, 18S, 20R)-9-(4-aminobutyl)-3-benzyl-12-(1H-indol-3-ylmethyl)-2, 5, 8, 11, 14, 17-hexaoxo-15-phenyl-6-[(4-phenylmethoxyphenyl)methyl]-1, 4, 7, 10, 13 and 16-hexazabicyclo[16.3.0]henicosan-20-yl] N-(2-aminoethyl)carbamate; 1421446-02-7; pasireotide aspartate; orb1982174; CHEMBL5314380; SCHEMBL30674027; CHEBI:72313; HY-16381B
Iupac Name
bis((2S)-2-aminobutanedioic acid);[(3S, 6S, 9S, 12R, 15S, 18S, 20R)-9-(4-aminobutyl)-3-benzyl-12-(1H-indol-3-ylmethyl)-2, 5, 8, 11, 14, 17-hexaoxo-15-phenyl-6-[(4-phenylmethoxyphenyl)methyl]-1, 4, 7, 10, 13 and 16-hexazabicyclo[16.3.0]henicosan-20-yl] N-(2-aminoethyl)carbamate
InChI
InChI=1S/C58H66N10O9.2C4H7NO4/c59-27-13-12-22-46-52(69)64-47(30-38-23-25-42(26-24-38)76-36-39-16-6-2-7-17-39)53(70)66-49(31-37-14-4-1-5-15-37)57(74)68-35-43(77-58(75)61-29-28-60)33-50(68)55(72)67-51(40-18-8-3-9-19-40)56(73)65-48(54(71)63-46)32-41-34-62-45-21-11-10-20-44(41)45;2*5-2(4(8)9)1-3(6)7/h1-11,14-21,23-26,34,43,46-51,62H,12-13,22,27-33,35-36,59-60H2,(H,61,75)(H,63,71)(H,64,69)(H,65,73)(H,66,70)(H,67,72);2*2H,1,5H2,(H,6,7)(H,8,9)/t43-,46+,47+,48-,49+,50+,51+;2*2-/m100/s1
