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protodeoxyviolaceinate

Properties

Image

Occurences in reactions

MNX_ID

MNXM97268

	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	0

formula

C₂₁H₁₄N₃O₂

charge

-1

mass

340.10915

reference

InChIKey

SFLGFRJGKHRRID-UHFFFAOYSA-M

InChI

InChI=1S/C21H15N3O2/c25-21(26)20-14(15-10-22-17-7-3-1-5-12(15)17)9-19(24-20)16-11-23-18-8-4-2-6-13(16)18/h1-11,22-24H,(H,25,26)/p-1

SMILES

O=C([O-])c1[nH]c(-c2c[nH]c3ccccc23)cc1-c1c[nH]c2ccccc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:90907 chebi:90907	protodeoxyviolaceinate 3,5-di(1H-indol-3-yl)-1H-pyrrole-2-carboxylate
kegg.compound:C21131 keggC:C21131	Protodeoxyviolaceinic acid Protodeoxyviolaceinate
metacyc.compound:CPD-14320 metacycM:CPD-14320 seed.compound:cpd24293 seedM:cpd24293	protodeoxyviolaceinate prodeoxyviolaceinate protodeoxyviolaceinic acid
CHEBI:90906 chebi:90906	protodeoxyviolaceinic acid 3,5-di(1H-indol-3-yl)-1H-pyrrole-2-carboxylic acid
keggC:M_C21131 seedM:M_cpd24293	secondary/obsolete/fantasy identifier