EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:15434 - magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester

ChEBI IDCHEBI:15434
ChEBI Namemagnesium 131-hydroxyprotoporphyrin 13-monomethyl ester
Stars
ASCII Namemagnesium 13(1)-hydroxyprotoporphyrin 13-monomethyl ester
Secondary ChEBI IDsCHEBI:10835, CHEBI:11322, CHEBI:29463
Last Modified13 April 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC35H34MgN4O5
Net Charge0
Average Mass614.985
Monoisotopic Mass614.23796
SMILESC=CC1=C(C)C2=Cc3c(C=C)c(C)c4[n]3[Mg-2]35[n]6c(c(C)c(C(O)CC(=O)OC)c6=CC6=[N+]3C(=C4)C(C)=C6CCC(=O)O)=CC1=[N+]25
InChIInChI=1S/C35H35N4O5.Mg/c1-8-21-17(3)24-12-25-19(5)23(10-11-33(41)42)30(38-25)15-31-35(32(40)16-34(43)44-7)20(6)27(39-31)14-29-22(9-2)18(4)26(37-29)13-28(21)36-24;/h8-9,12-15,32,40H,1-2,10-11,16H2,3-7H3,(H2-,36,37,38,39,41,42);/q-1;+2/p-1/b24-12-,25-12-,26-13-,27-14-,28-13-,29-14-,30-15-,31-15-;
InChIKeyMVCDIAGKFJFPBB-JXBSUKTBSA-M
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
cofactor  An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
ChEBI Ontology
Outgoing Relation(s)
magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester (CHEBI:15434) has functional parent magnesium protoporphyrin 13-monomethyl ester (CHEBI:15432)
magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester (CHEBI:15434) is a dicarboxylic acid monoester (CHEBI:36244)
magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester (CHEBI:15434) is a magnesium porphyrin (CHEBI:25111)
magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester (CHEBI:15434) is a methyl ester (CHEBI:25248)
magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester (CHEBI:15434) is conjugate acid of magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester(1−) (CHEBI:60489)
Incoming Relation(s)
magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester(1−) (CHEBI:60489) is conjugate base of magnesium 131-hydroxyprotoporphyrin 13-monomethyl ester (CHEBI:15434)
Synonyms  Source
[7,12-diethenyl-18-(3-ethoxy-1-hydroxy-3-oxopropyl)-3,8,13,17-tetramethylporphyrin-2-propanoato]magnesium(II)JCBN
13(1)-Hydroxy-magnesium-protoporphyrin IX 13-monomethyl esterKEGG COMPOUND
13(1)-Hydroxy-Mg-protoporphyrin IX 13-monomethyl esterKEGG COMPOUND
Manual XrefsDatabases
C11829KEGG COMPOUND
Registry NumbersSources
Beilstein:5715484Beilstein