Feedback

heme b

Properties

Image

Occurences in reactions

MNX_ID

MNXM249

	#reac
in my sandbox	0
in MNXref (generic)	85
in models (compartimentalized)	53

formula

C₃₄H₃₀FeN₄O₄

charge

-2

mass

614.16274

reference

chebi:60344

InChIKey

KABFMIBPWCXCRK-RGGAHWMASA-J

InChI

InChI=1S/C34H34N4O4.Fe/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-4/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;

SMILES

C=CC1=C(C)C2=Cc3c(C=C)c(C)c4n3[Fe-2]35n6c(c(C)c(CCC(=O)[O-])c6=CC6=[N+]3C(=C4)C(C)=C6CCC(=O)[O-])=CC1=[N+]25

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60344 chebi:60344	heme b [3,3'-(3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-diyl-kappa(4)N(21),N(22),N(23),N(24))dipropanoato(4-)]ferrate(2-) ferroheme b(2-)
hmdb:HMDB0003178	Heme 4,20-bis(2-carboxyethyl)-10,15-diethenyl-5,9,14,19-tetramethyl-2lambda5,22,23lambda5,25-tetraaza-1-ferraoctacyclo[11.9.1.1^{1,8}.1^{3,21}.0^{2,6}.0^{16,23}.0^{18,22}.0^{11,25}]pentacosa-2,4,6,8,10,12,14,16(23),17,19,21(24)-undecaene-2,23-bis(ylium)-1,1-diuide Fe(ppix) Ferroprotoheme Ferroprotoporphyrin IX Ferrous protoheme Ferrous protoheme IX Haem Heme b Iron(II) protoporphyrin IX Protoferroheme Protoheme Protoheme IX [3,7,12,17-Tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron(II) [Fe(ppix)]
kegg.compound:C00032 keggC:C00032	Heme Haem Heme B Protoheme Protoheme IX
sabiork.compound:5000 sabiorkM:5000	Heme Haem Protoheme Protoheme IX
bigg.metabolite:pheme biggM:pheme	Protoheme
reactome:R-ALL-113569 reactomeM:R-ALL-113569 reactome:R-ALL-189444 reactomeM:R-ALL-189444 reactome:R-ALL-198842 reactomeM:R-ALL-198842 reactome:R-ALL-2230964 reactomeM:R-ALL-2230964 reactome:R-ALL-71185 reactomeM:R-ALL-71185 reactome:R-ALL-917877 reactomeM:R-ALL-917877 reactome:R-ALL-917919 reactomeM:R-ALL-917919 CHEBI:17627 chebi:17627	ferroheme b (protoporphyrinato)iron(II) Fe(ppIX) Haem Heme Protoheme [3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron(II) [Fe(ppIX)] ferroprotoheme ferroprotoporphyrin IX ferrous protoheme ferrous protoheme IX iron(II) protoporphyrin IX protoferroheme
reactome:R-ALL-2168843 reactomeM:R-ALL-2168843 reactome:R-ALL-2311355 reactomeM:R-ALL-2311355 CHEBI:26355 chebi:26355	heme b (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)iron (protoporphyrinato)iron Haem Heme B PROTOPORPHYRIN IX CONTAINING FE Protoheme Protoheme IX [3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron haem b heme protoheme
metacyc.compound:PROTOHEME metacycM:PROTOHEME	protoheme ferroheme b ferroprotoporphyrin IX protoheme IX
hmdb:HMDB03178 chebi:14957 chebi:5651 biggM:M_pheme keggC:M_C00032	secondary/obsolete/fantasy identifier