(2S)-N-[(1S)-1-[[(2S)-1-[(2S)-2-[[(1S)-1-carbamoyl-2-(1H-indol-3-yl)ethyl]carbamoylmethylcarbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxo-propan-2-yl]carbamoyl]-2-phenyl-ethyl]-2-[[(2S)-4-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanoyl]amino]butanediamide
Molecular Formula:
C45H59N11O11
InChI: InChI=1/C45H59N11O11/c1-24(2)17-31(52-40(62)29-14-15-37(59)50-29)41(63)54-33(20-36(46)58)43(65)53-32(18-25-9-4-3-5-10-25)42(64)55-34(23-57)45(67)56-16-8-13-35(56)44(66)49-22-38(60)51-30(39(47)61)19-26-21-48-28-12-7-6-11-27(26)28/h3-7,9-12,21,24,29-35,48,57H,8,13-20,22-23H2,1-2H3,(H2,46,58)(H2,47,61)(H,49,66)(H,50,59)(H,51,60)(H,52,62)(H,53,65)(H,54,63)(H,55,64)/t29-,30-,31-,32-,33-,34-,35-/m0/s1/f/h49-55H,46-47H2
InChIKey: InChIKey=XFGMPZRFMGBTDI-ZBOAGDPSDN
SMILES: CC(C)CC(C(=O)NC(CC(=O)N)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CO)C(=O)N2CCCC2C(=O)NCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)N)NC(=O)C5CCC(=O)N5
Names:
(2S)-N-[(1S)-1-[[(2S)-1-[(2S)-2-[[(1S)-1-carbamoyl-2-(1H-indol-3-yl)ethyl]carbamoylmethylcarbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxo-propan-2-yl]carbamoyl]-2-phenyl-ethyl]-2-[[(2S)-4-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanoyl]amino]butanediamide
Registries:
PubChem CID 123998
PubChem ID 10240946
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|