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Chemical structure of Phepropeptin D

GC92054

Phepropeptin D

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

Phepropeptin D is a cyclic peptide originally isolated from Streptomyces that has proteasome inhibitory activity

ChemicalCAS396729-26-3MW730.9FormulaC41H58N6O6
CAS number
396729-26-3
Molecular weight
730.9
Formula
C41H58N6O6
InChIKey
RDFYNJULNCUNKD-KNDPMYCDSA-N
Catalogue number
GC92054
Brand
GLPBIO
Computed properties PubChem CID 11814600 · XLogP 5.9 · TPSA 166 Ų · H-bond donors 5
XLogP
5.9
TPSA
166 Ų
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
53

SMILES CC[C@H](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)CC3=CC=CC=C3)CC4=CC=CC=C4)CC(C)C

Computed descriptors from PubChem (CID 11814600), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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