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Chemical structure of Elasnin

GC40965

Elasnin

Also known as 3,5-dibutyl-4-hydroxy-6-(6-oxoundecan-5-yl)pyran-2-one

Elasnin is a product isolated from certain strains of Streptomyces that acts as a reversible inhibitor of elastase with IC50 values of 1·3 and 30 μg/ml for human granulocyte and pancreatic enzymes, respectively

ChemicalCAS68112-21-0MW392.6FormulaC24H40O4
CAS number
68112-21-0
Molecular weight
392.6
Formula
C24H40O4
Solubility
Soluble in DMSO
InChIKey
SNSPVFCYLPZTRZ-UHFFFAOYSA-N
Catalogue number
GC40965
Brand
GLPBIO
Computed properties PubChem CID 54685126 · XLogP 7 · TPSA 63.6 Ų · H-bond donors 1
XLogP
7
TPSA
63.6 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
15
Heavy atoms
28

SMILES CCCCCC(=O)C(CCCC)C1=C(C(=C(C(=O)O1)CCCC)O)CCCC

Computed descriptors from PubChem (CID 54685126), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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