Molecular Formula: C50H75N8O7
Molecular weight: 900.1799
InChi: InChI=1S/C50H75N8O7/c1-46(2,3)65-45(63)55-40(22-37-29-51-31-57(37)8)43(61)56-50-25-34-19-35(26-50)24-49(23-34,30-50)44(62)54-39(21-33-17-13-10-14-18-33)42(60)53-38(20-32-15-11-9-12-16-32)41(59)52-36-27-47(4,5)58(64)48(6,7)28-36/h9,11-12,15-16,29,31,33-36,38-40H,10,13-14,17-28,30H2,1-8H3,(H,52,59)(H,53,60)(H,54,62)(H,55,63)(H,56,61)/t34-,35+,38-,39-,40-,49+,50-/m0/s1
InChi Key: PZQPVQUCZMWMBF-RQHXZIJNSA-N
SMILES: [C@@]12(C[C@@]3(C[C@H](C1)C[C@H](C2)C3)NC(=O)[C@H](Cc1n(cnc1)C)NC(=O)OC(C)(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NC1CC(N(C(C1)(C)C)[O])(C)C)Cc1ccccc1)CC1CCCCC1
Chemical Name
Boc-L-(π-Me)-His-AGly-L-Cha-L-Phe-NH-TEMPO
Boc-L-(π-Me)-His-AGly-L-Cha-L-Phe-NH-TEMPO