Basic information
- Standard SMILES
CCC(C)C(NC(=O)OCc1ccccc1)C(=O)NC(CCC(=O)OC(C)(C)C)C(=O)NC(C)C(=O)NC(C=O)CC(C)C- InChIKey
TYFTWYMXUWCOOB-UHFFFAOYSA-N- Molecular formula
- C32H50N4O8
- Average molar mass
- 618.8 g/mol
- Monoisotopic mass
- 618.36286457
Names & identifiers
- Preferred name
- Proteasome Inhibitor I
- IUPAC
- tert-butyl 5-[[1-[(4-methyl-1-oxopentan-2-yl)amino]-1-oxopropan-2-yl]amino]-4-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-5-oxopentanoate
Names & synonyms
Z-Ile-Glu(O-t-butyl)-Ala-LeucinalProteasome Inhibitor IIEALSCHEMBL30500174SDP-3818-PIC32H50N4O8DTXSID301356520IAT-3169-VZ-Ile-Glu(OtBu)-Ala-Leu-H (aldehyde)Abz-Leu-Ala-Gln-Ala-Val-Arg-Ser-Ser-Ser-Arg-Dap(Dnp)-NH2tert-Butyl 4-(2-{[(benzyloxy)carbonyl]amino}-3-methylpentanamido)-5-({1-[(4-methyl-1-oxo-2-pentanyl)amino]-1-oxo-2-propanyl}amino)-5-oxopentanoatetert-butyl 4-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-5-[[2-[(1-formyl-3-methyl-butyl)amino]-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoate
Database identifiers
- PubChem CID
- 24906271
- DTXSID
DTXSID301356520
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 169 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 20
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 958
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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