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Chemical structure of Stannsoporfin

GC17594

Stannsoporfin

Also listed as Tin Mesoporphyrin IX (chloride)

Tin Mesoporphyrin IX (chloride) (Stannsoporfin) is a heme oxygenase (HO) inhibitor being developed for the prevention of hyperbilirubinemia in infants at risk of developing jaundice, extracted from patent WO2011103196A1

ChemicalCAS106344-20-1MW754.3FormulaC34H34Cl2N4O4Sn • 2H
CAS number
106344-20-1
Molecular weight
754.3
Formula
C34H34Cl2N4O4Sn • 2H
Solubility
≤0·5mg/ml in DMSO;1mg/ml in dimethyl formamide
InChIKey
LLDZJTIZVZFNCM-UHFFFAOYSA-J
Catalogue number
GC17594
Brand
GLPBIO
Computed properties PubChem CID 15978579 · TPSA 102 Ų · H-bond donors 2 · H-bond acceptors 10
TPSA
102 Ų
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
8
Heavy atoms
45

SMILES CCC1=C(C2=NC1=CC3=C(C(=C([N-]3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5C)CC)[N-]4)C)CCC(=O)O)CCC(=O)O)C)C.[Cl-].[Cl-].[Sn+4]

Computed descriptors from PubChem (CID 15978579), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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