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Mg-protoporphyrin IX 13-monomethyl ester

Properties

Image

Occurences in reactions

MNX_ID

MNXM741289

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	5

formula

C₃₅H₃₃MgN₄O₄

charge

-1

mass

597.23577

reference

chebi:60491

InChIKey

JHTBRMHXRULRGV-NCCDZXNNSA-L

InChI

InChI=1S/C35H35N4O4.Mg/c1-8-22-18(3)26-14-27-20(5)24(10-12-34(40)41)32(38-27)17-33-25(11-13-35(42)43-7)21(6)29(39-33)16-31-23(9-2)19(4)28(37-31)15-30(22)36-26;/h8-9,14-17H,1-2,10-13H2,3-7H3,(H2-,36,37,38,39,40,41);/q-1;+2/p-2/b26-14-,27-14-,28-15-,29-16-,30-15-,31-16-,32-17-,33-17-;

SMILES

C=CC1=C(C)C2=[N+]3C1=Cc1c(C)c(CCC(=O)OC)c4n1[Mg-2]31n3c(c(C)c(C=C)c3=C2)=CC2=[N+]1C(=C4)C(CCC(=O)[O-])=C2C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60491 chebi:60491	Mg-protoporphyrin IX 13-monomethyl ester magnesium protoporphyrin 13-monomethyl ester(1-) magnesium protoporphyrinate 13-monomethyl ester
kegg.compound:C04536 keggC:C04536	Magnesium protoporphyrin monomethyl ester Magnesium protoporphyrin IX 13-methyl ester Magnesium-protoporphyrin IX 13-monomethyl ester Mg-Protoporphyrin IX 13-monomethyl ester
CHEBI:15432 chebi:15432	magnesium protoporphyrin 13-monomethyl ester Magnesium protoporphyrin IX 13-methyl ester Magnesium protoporphyrin monomethyl ester Magnesium-protoporphyrin IX 13-monomethyl ester Mg-Protoporphyrin IX 13-monomethyl ester [7,12-diethenyl-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethylporphyrin-2-propanoato]magnesium(II)
chebi:10794 chebi:14554 chebi:14555 chebi:25110 chebi:6639 chebi:77666 keggC:M_C04536	secondary/obsolete/fantasy identifier