(2S)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-N'-[(1S)-1-[[(1S)-1-[[(4S,5S,7S)-5-hydroxy-2,8-dimethyl-7-[[(1S,2S)-2-methyl-1-[(1-oxidopyridin-6-yl)methylcarbamoyl]butyl]carbamoyl]nonan-4-yl]carbamoyl]-2-(3H-imidazol-4-yl)ethyl]-methyl-carbamoyl]-2-phenyl-ethyl]pyrrolidine-1,2-dicarboxamide
Molecular Formula:
C50H76N10O11
InChI: InChI=1/C50H76N10O11/c1-8-33(6)43(47(68)52-26-36-17-12-13-20-60(36)71)56-44(65)37(32(4)5)24-42(64)38(21-31(2)3)54-46(67)41(23-35-25-51-30-53-35)58(7)48(69)39(22-34-15-10-9-11-16-34)55-45(66)40-18-14-19-59(40)49(70)57-50(27-61,28-62)29-63/h9-13,15-17,20,25,30-33,37-43,61-64H,8,14,18-19,21-24,26-29H2,1-7H3,(H,51,53)(H,52,68)(H,54,67)(H,55,66)(H,56,65)(H,57,70)/t33-,37-,38-,39-,40-,41-,42-,43-/m0/s1/f/h52-57H
InChIKey: InChIKey=MLWGQBSRGOGMDI-BKLYMZOQDB
SMILES: CCC(C)C(C(=O)NCC1=CC=CC=[N+]1[O-])NC(=O)C(CC(C(CC(C)C)NC(=O)C(CC2=CN=CN2)N(C)C(=O)C(CC3=CC=CC=C3)NC(=O)C4CCCN4C(=O)NC(CO)(CO)CO)O)C(C)C
Names:
(2S)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-N'-[(1S)-1-[[(1S)-1-[[(4S,5S,7S)-5-hydroxy-2,8-dimethyl-7-[[(1S,2S)-2-methyl-1-[(1-oxidopyridin-6-yl)methylcarbamoyl]butyl]carbamoyl]nonan-4-yl]carbamoyl]-2-(3H-imidazol-4-yl)ethyl]-methyl-carbamoyl]-2-phenyl-ethyl]pyrrolidine-1,2-dicarboxamide
Registries:
PubChem CID 164257
PubChem ID 10255413
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|