benzyl N-[(1S)-3-amino-1-[[1-benzyl-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]carbamoyl]-3-oxo-propyl]carbamate
Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC(Cc1ccccc1)C(O)C(Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1- InChIKey
OFPUYQBCXOWLTJ-YVWUVWRGSA-N- Molecular formula
- C34H42N4O7
- Average molar mass
- 618.7 g/mol
Names & identifiers
- Preferred name
- benzyl N-[(1S)-3-amino-1-[[1-benzyl-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]carbamoyl]-3-oxo-propyl]carbamate
- IUPAC
- benzyl N-[(2S)-4-amino-1-[[3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1,5-diphenylpentan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamate
Names & synonyms
SCHEMBL7270738OFPUYQBCXOWLTJ-YVWUVWRGSA-N2-(t-Butyloxycarbonylamino)-4-(Cbz-asparaginyl-amino)-1,5-diphenyl-3-hydroxypentanebenzyl N-[(1S)-3-amino-1-[[1-benzyl-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]carbamoyl]-3-oxo-propyl]carbamatePentitol, 2-[[(2S)-4-amino-1,4-dioxo-2-[[(phenylmethoxy)carbonyl]amino]butyl]amino]-1,2,4,5-tetradeoxy-4-[[(1,1-dimethylethoxy)carbonyl]amino]-1,5-diphenyl-
Database identifiers
- PubChem CID
- 3011024
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 169 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 17
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 937
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Related reactions
1 records
Compound notes
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