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Chemical structure of Phepropeptin C

GC92049

Phepropeptin C

Also known as (3R,6S,9S,12R,15S,18R)-3-benzyl-9-butan-2-yl-6,12,15-tris(2-methylpropyl)-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosane-2,5,8,11,14,17-hexone

Phepropeptin C is a cyclic peptide originally isolated from Streptomyces that has proteasome inhibition activity

ChemicalCAS396729-25-2MW696.9FormulaC38H60N6O6
CAS number
396729-25-2
Molecular weight
696.9
Formula
C38H60N6O6
InChIKey
AKQUYKYHJPCGHJ-OMPYVEQSSA-N
Catalogue number
GC92049
Brand
GLPBIO
Computed properties PubChem CID 139586868 · XLogP 5.7 · TPSA 166 Ų · H-bond donors 5
XLogP
5.7
TPSA
166 Ų
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
50

SMILES CCC(C)[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2CCC[C@@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CC(C)C)CC(C)C)CC3=CC=CC=C3)CC(C)C

Computed descriptors from PubChem (CID 139586868), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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