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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 89930833Generated: November 3, 2026

methyl 4-((((3S,5S)-1-((S)-2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-3,3-dimethylbutanoyl)-5-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidin-3-yl)oxy)methyl)benzoate

https://huagongshe.com/en/chemical/89930833

methyl 4-((((3S,5S)-1-((S)-2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-3,3-dimethylbutanoyl)-5-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidin-3-yl)oxy)methyl)benzoate molecular structure

Identifiers & Physical Properties

Molecular formulaC39H54N4O8
Average molar mass706.9 g/mol
Monoisotopic mass706.39416469 g/mol
SMILESCOC(=O)c1ccc(CO[C@H]2C[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N(C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)OC(C)(C)C)C(C)(C)C)C2)cc1
InChIKeyPCDNFXCJKKWVMT-HKAFNGCHSA-N
PubChem CID89930833

Chemical & Physical Properties

XLogP5.2
Topological polar surface area144
Hydrogen bond donors2
Hydrogen bond acceptors8
Rotatable bonds14
Heavy atoms51
Formal charge0
Complexity1,240