Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**
 Feedback

Heme C

PropertiesImageOccurences in reactions
MNX_IDMNXM737471Image of MNXM737471
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC40H46FeN6O8S2
charge0
mass858.807
referencekeggC:C15817
InChIKeyWKYVSAJNXWVOCL-KARXENAMSA-L
InChIInChI=1S/C40H48N6O8S2.Fe/c1-17-23(7-9-35(47)48)31-14-32-24(8-10-36(49)50)18(2)28(44-32)12-33-38(22(6)56-16-26(42)40(53)54)20(4)30(46-33)13-34-37(21(5)55-15-25(41)39(51)52)19(3)29(45-34)11-27(17)43-31;/h11-14,21-22,25-26H,7-10,15-16,41-42H2,1-6H3,(H6,43,44,45,46,47,48,49,50,51,52,53,54);/q;+2/p-2/b27-11-,28-12-,29-11-,30-13-,31-14-,32-14-,33-12-,34-13-;/t21?,22?,25-,26-;/m0./s1
SMILES[CH3:1][c:17]1[c:23]([CH2:7][CH2:9][C:35](=[O:47])[OH:48])[c:31]2[cH:14][c:32]3[n:44][c:28]([cH:12][c:33]4[n:46][c:30]([cH:13][c:34]5[c:37]([CH:21]([CH3:5])[S:55][CH2:15][C@@H:25]([C:39](=[O:51])[OH:52])[NH3+:41])[c:19]([CH3:3])[c:29]([cH:11][c:27]1[n-:43]2)[nH:45]5)[C:20]([CH3:4])=[C:38]4[CH:22]([CH3:6])[S:56][CH2:16][C@@H:26]([C:40](=[O:53])[OH:54])[NH2:42])[C:18]([CH3:2])=[C:24]3[CH2:8][CH2:10][C:36](=[O:49])[OH:50].[Fe+2:57]
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
kegg.compound:C15817
keggC:C15817 		Heme C
seed.compound:cpd14553
seedM:cpd14553 		C15817
keggC:M_C15817
seedM:M_cpd14553 		secondary/obsolete/fantasy identifier