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Chemical structure of Pyrroloquinoline quinone

GC44793

Pyrroloquinoline quinone

Also known as 4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid

Pyrroloquinoline quinone was reported to be a new mammalian lactate dehydrogenase (LDH) coenzyme

ChemicalCAS72909-34-3MW330.2FormulaC14H6N2O8
CAS number
72909-34-3
Molecular weight
330.2
Formula
C14H6N2O8
Solubility
DMF： 1 mg/ml,DMSO： 2 mg/ml,Ethanol： 0·1 mg/ml,PBS (pH 7·2)： 0·1 mg/ml
InChIKey
MMXZSJMASHPLLR-UHFFFAOYSA-N
Catalogue number
GC44793
Brand
GLPBIO
Computed properties PubChem CID 1024 · XLogP -0.1 · TPSA 175 Ų · H-bond donors 4
XLogP
-0.1
TPSA
175 Ų
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
3
Heavy atoms
24

SMILES C1=C(C2=C(C(=O)C(=O)C3=C2NC(=C3)C(=O)O)N=C1C(=O)O)C(=O)O

Computed descriptors from PubChem (CID 1024), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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