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Chemical structure of Methoxatin disodium salt (Pyrroloquinolinequinone disodium salt)

GC31766

Methoxatin disodium salt (Pyrroloquinolinequinone disodium salt)

Also known as disodium;2-carboxy-4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-7,9-dicarboxylate

Methoxatin disodium salt (Pyrroloquinolinequinone disodium salt), a redox co-factor, is an anionic, redox-cycling orthoquinone

ChemicalCAS122628-50-6MW374.17FormulaC14H4N2Na2O8
CAS number
122628-50-6
Molecular weight
374.17
Formula
C14H4N2Na2O8
Solubility
Water : 6·16 mg/mL (16·46 mM)
InChIKey
UFVBOGYDCJNLPM-UHFFFAOYSA-L
Catalogue number
GC31766
Brand
GLPBIO
Computed properties PubChem CID 3078772 · TPSA 180 Ų · H-bond donors 2 · H-bond acceptors 9
TPSA
180 Ų
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
1
Heavy atoms
26

SMILES C1=C(C2=C(C(=O)C(=O)C3=C2NC(=C3)C(=O)O)N=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+]

Computed descriptors from PubChem (CID 3078772), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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