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hemeA

PropertiesImageOccurences in reactions
MNX_IDMNXM737853Image of MNXM737853
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
formulaC49H54FeN4O6
charge-2
mass850.34037
referenceseedM:cpd11312
InChIKeyZGGYGTCPXNDTRV-RCPTXUIBSA-J
InChIInChI=1S/C49H58N4O6.Fe/c1-9-34-31(6)39-25-45-49(46(55)18-12-17-30(5)16-11-15-29(4)14-10-13-28(2)3)33(8)40(52-45)24-44-37(27-54)36(20-22-48(58)59)43(53-44)26-42-35(19-21-47(56)57)32(7)38(51-42)23-41(34)50-39;/h9,13,15,17,23-27,46,55H,1,10-12,14,16,18-22H2,2-8H3,(H4,50,51,52,53,54,56,57,58,59);/q;+2/p-4/b29-15+,30-17+,38-23?,39-25?,40-24-,41-23-,42-26?,43-26-,44-24?,45-25-;
SMILESC=CC1=C(C)C2=N/C1=C\c1c(C)c(CCC(=O)[O-])c3n1[Fe]n1/c(c(C)c(C(O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)/c1=C/2)=C\C1=N/C(=C\3)C(CCC(=O)[O-])=C1C=O
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd11312
seedM:cpd11312 		hemeA
Heme A
seedM:M_cpd11312 secondary/obsolete/fantasy identifier