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Chemical structure of Dihydrochlamydocin

GC43460

Dihydrochlamydocin

Also known as (3S,9S,12R)-3-benzyl-9-[(7R)-7-hydroxy-6-oxooctyl]-6,6-dimethyl-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone

Dihydrochlamydocin is a cyclic tetrapeptide with putative histone deacetylase (HDAC) inhibitory activity

ChemicalCAS157618-75-2MW528.6FormulaC28H40N4O6
CAS number
157618-75-2
Molecular weight
528.6
Formula
C28H40N4O6
Solubility
DMSO： soluble,Ethanol： soluble
InChIKey
UXOLDMJAFJDQSE-RYFAJOAYSA-N
Catalogue number
GC43460
Brand
GLPBIO
Computed properties PubChem CID 10392191 · XLogP 1.7 · TPSA 145 Ų · H-bond donors 4
XLogP
1.7
TPSA
145 Ų
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
38

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

Computed descriptors from PubChem (CID 10392191), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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