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pelargonidin

Properties

Image

Occurences in reactions

MNX_ID

MNXM3333

	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	3

formula

C₁₅H₉O₅

charge

-1

mass

269.04555

reference

chebi:144777

InChIKey

XVFMGWDSJLBXDZ-UHFFFAOYSA-M

InChI

InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7H,(H3-,16,17,18,19)/p-1

SMILES

[O-]c1cc2c([O-])cc(O)cc2[o+]c1-c1ccc(O)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:144777 chebi:144777	pelargonidin 7-hydroxy-2-(4-hydroxyphenyl)-1-benzopyran-1-ium-3,5-bis(olate) 7-hydroxy-2-(4-hydroxyphenyl)chromenium-3,5-bis(olate) pelargonidin(1-)
lipidmaps:LMPK12010003 lipidmapsM:LMPK12010003	Pelargonidin
seed.compound:cpd03501 seedM:cpd03501	Pelargonidin 1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-, chloride 3,4',5,7-Tetrahydroxyflavylium chloride 3,4',5,7-tetrahydroxyflavylium chloride 3,5,7-Trihydroxy-2-(4-hydroxyphenil)-1-benzopyrylium chloride 3,5,7-Trihydroxy-2-(4-hydroxyphenyl)benzopyrylium chloride 3,5,7-trihydroxy-2-(4-hydroxyphenyl)benzopyrylium chloride Flavylium, 3,4',5,7-tetrahydroxy-, chloride Pelargonidin chloride Pelargonidol chloride pelargonidin
hmdb:HMDB0003263	Pelargonidin 3,4',5,7-Tetrahydroxyflavylium chloride 3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium 3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium chloride 3,5,7-Trihydroxy-2-(4-hydroxyphenyl)benzopyrylium chloride 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2H-chromen-2-ylium Pelargonidin chloride Pelargonidine Pelargonidol chloride Pelarogonidin
sabiork.compound:8254 sabiorkM:8254 kegg.compound:C05904 keggC:C05904	Pelargonidin 3,4',5,7-Tetrahydroxyflavylium chloride 3,5,7-Trihydroxy-2-(4-hydroxyphenyl)benzopyrylium chloride Pelargonidin chloride Pelargonidol chloride
metacyc.compound:PELARGONIDIN-CMPD metacycM:PELARGONIDIN-CMPD	pelargonidin
CHEBI:25863 chebi:25863	pelargonidin 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromenylium
hmdb:HMDB03263 keggC:M_C05904 seedM:M_cpd03501	secondary/obsolete/fantasy identifier