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pyrroloquinoline quinone

Properties

Image

Occurences in reactions

MNX_ID

MNXM601

	#reac
in my sandbox	0
in MNXref (generic)	29
in models (compartimentalized)	12

formula

C₁₄H₃N₂O₈

charge

-3

mass

326.99059

reference

chebi:58442

InChIKey

MMXZSJMASHPLLR-UHFFFAOYSA-K

InChI

InChI=1S/C14H6N2O8/c17-10-4-2-6(14(23)24)15-8(4)7-3(12(19)20)1-5(13(21)22)16-9(7)11(10)18/h1-2,15H,(H,19,20)(H,21,22)(H,23,24)/p-3

SMILES

O=C([O-])c1cc(C(=O)[O-])c2c(n1)C(=O)C(=O)c1cc(C(=O)[O-])[nH]c1-2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58442 chebi:58442	pyrroloquinoline quinone 4,5-dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate pyrroloquinoline quinone trianion pyrroloquinoline quinone(3-)
kegg.compound:C00113 keggC:C00113	PQQ 4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate Methoxatin Pyrrolo-quinoline quinone Pyrroloquinoline quinone Pyrroloquinoline-quinone
sabiork.compound:5007 sabiorkM:5007	PQQ Methoxatin Pyrrolo-quinoline quinone Pyrroloquinoline quinone Pyrroloquinoline-quinone
hmdb:HMDB0013636	Pyrroloquinoline quinone 2,4,6-Tricarboxylic-pyrrolo[2,3-5,6]quinoline 8,9-quinone 2,7,9-Tricarboxy-1H-pyrrolo(2,3-F)quinoline-4,5-dione 2,7,9-Tricarboxy-1H-pyrrolo-(2,3-F)quinoline-4,5-dione 2,7,9-Tricarboxypyrroloquinoline quinone 4,5-Dihydro-4,5-dioxo-1-H-pyrrolo(2,3-F)quinoline-2,7,9-tricarboxylic acid 4,5-Dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylate 4,5-Dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylic acid 4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-F]quinoline-2,7,9-tricarboxylate 4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-F]quinoline-2,7,9-tricarboxylic acid 4,5-dioxo-1H,4H,5H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid Coenzyme PQQ Coenzyme, PQQ Cofactor, PQQ Methoxatin PQQ PQQ Coenzyme PQQ Cofactor PQQ, Coenzyme Pyrrolo quinoline quinone Pyrrolo-quinoline quinone Pyrroloquinoline-quinone Quinone, pyrrolo-quinoline Quinone, pyrroloquinoline pyrroloquinoline quinone
bigg.metabolite:pqq biggM:pqq	Pyrroloquinoline-quinone
seed.compound:cpd00097 seedM:cpd00097	Pyrroloquinoline-quinone 2,7,9-tricarboxy-1H-pyrrolo[2,3-f]quinoline-4,5-dione 4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9- tricarboxylate 4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate Methoxatin PQQ Pyrrolo-quinoline quinone Pyrroloquinoline quinone pqq pyrroloquinoline quinone
metacyc.compound:PQQ metacycM:PQQ	pyrroloquinoline quinone 2,4,6-tricarboxylic-pyrrolo[2,3-5,6]quinoline 8,9-quinone 2,7,9-tricarboxy-1H-pyrrolo(2,3-f)quinoline-4,5-dione 2,7,9-tricarboxy-1H-pyrrolo[2,3-f]quinoline-4,5-dione 4,5-dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylic acid 4,5-dioxo-3alpha,4,5,6,7,8,9,9beta-octahydro-1H pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate 4,5-dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate PQQ coenzyme PQQ methoxatin
reactome:R-ALL-351594 reactomeM:R-ALL-351594 CHEBI:18315 chebi:18315	pyrroloquinoline quinone 2,4,6-tricarboxylic-pyrrolo[2,3-5,6]quinoline 8,9-quinone 2,7,9-tricarboxy-1H-pyrrolo(2,3-f)quinoline-4,5-dione 4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate 4,5-dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylic acid 4,5-dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid Methoxatin PQQ PYRROLOQUINOLINE QUINONE Pyrrolo-quinoline quinone Pyrroloquinoline quinone Pyrroloquinoline-quinone coenzyme PQQ methoxatin
hmdb:HMDB13636 chebi:14986 chebi:26460 chebi:45251 chebi:49082 chebi:7881 biggM:M_pqq keggC:M_C00113 seedM:M_cpd00097	secondary/obsolete/fantasy identifier