MMP

N-METHYLMESOPORPHYRIN

Created:	1999-07-08
Last modified:	2011-06-04

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14 entries where MMP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	83
Chiral Atom Count	0
Bond Count	87
Aromatic Bond Count	22

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Chemical Component Summary
Name	N-METHYLMESOPORPHYRIN
Systematic Name (OpenEye OEToolkits)	n/a
Formula	C₃₅ H₄₀ N₄ O₄
Molecular Weight	580.716
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)CCc3c(c4cc1nc(C(=C1CC)C)cc5n(c(cc2nc(C(=C2C)CCC(=O)O)cc3n4)c(c5CC)C)C)C
SMILES	CACTVS	3.341	CCc1c(C)c2cc3n(C)c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(O)=O)c(CCC(O)=O)c4C)c(C)c3CC
SMILES	OpenEye OEToolkits	1.5.0	CCc1c(c2cc3nc(cc4c(c(c([nH]4)cc5nc(cc1n2C)C(=C5CC)C)C)CCC(=O)O)C(=C3C)CCC(=O)O)C
Canonical SMILES	CACTVS	3.341	CCc1c(C)c2cc3n(C)c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(O)=O)c(CCC(O)=O)c4C)c(C)c3CC
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCc1c(c2cc3nc(\cc/4\c(c(/c(/[nH]4)c/c5n/c(c\c1n2C)/C(=C5CC)C)C)CCC(=O)O)C(=C3C)CCC(=O)O)C
InChI	InChI	1.03	InChI=1S/C35H40N4O4/c1-8-22-18(3)28-17-33-23(9-2)21(6)32(39(33)7)16-27-20(5)25(11-13-35(42)43)31(38-27)15-30-24(10-12-34(40)41)19(4)26(36-30)14-29(22)37-28/h14-17,36H,8-13H2,1-7H3,(H,40,41)(H,42,43)/b26-14-,27-16-,28-17-,29-14-,30-15-,31-15-,32-16-,33-17-
InChIKey	InChI	1.03	YNWHQWMCLCANDI-YIYRCNGCSA-N

Drug Info: DrugBank

DrugBank ID	DB01911
Name	N-Methylmesoporphyrin
Groups	experimental
Description	N-methylmesoporphyrin is a solid. This compound belongs to the porphyrins. These are compounds containing a fundamental skeleton of four pyrrole nuclei united through the alpha-positions by four methine groups to form a macrocyclic structure. This medication is known to target ferrochelatase.
Synonyms	N-Methylmesoporphyrin
Categories	Biological Factors Heterocyclic Compounds, Fused-Ring Pigments, Biological Porphyrins
CAS number	142234-85-3

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Ferrochelatase	MSRKKMGLLVMAYGTPYKEEDIERYYTHIRRGRKPEPEMLQDLKDRYEAI...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682