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cobalt-precorrin-2

PropertiesImageOccurences in reactions
MNX_IDMNXM499659Image of MNXM499659
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 4
formulaC42H37CoN4O16
charge-9
mass912.15859
referencemetacycM:CPD-9039
InChIKeyLSYVTVRLOVEXCI-URAPKPMPSA-E
InChIInChI=1S/C42H46N4O16.Co/c1-41(17-39(59)60)23(5-9-35(51)52)29-14-27-21(11-37(55)56)19(3-7-33(47)48)25(43-27)13-26-20(4-8-34(49)50)22(12-38(57)58)28(44-26)15-31-42(2,18-40(61)62)24(6-10-36(53)54)30(46-31)16-32(41)45-29;/h14-16,23-24H,3-13,17-18H2,1-2H3,(H9,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62);/q-2;+2/p-9/b29-14-,31-15-;/t23-,24-,41+,42+;/m1./s1
SMILESC[C@@]1(CC(=O)[O-])C2=CC3=[N+]4C(=Cc5c(CC(=O)[O-])c(CCC(=O)[O-])c6n5[Co-2]45N2C(=Cc2c(CC(=O)[O-])c(CCC(=O)[O-])c(n25)C6)[C@H]1CCC(=O)[O-])[C@@](C)(CC(=O)[O-])[C@@H]3CCC(=O)[O-]
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Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-9039
metacycM:CPD-9039
cobalt-precorrin-2
cobalt-dihydrosirohydrochlorin
bigg.metabolite:copre2
biggM:copre2
Cobalt-precorrin-2
seed.compound:cpd25539
seedM:cpd25539
cobalt-dihydrosirohydrochlorin
cobalt-precorrin 2
cobalt-precorrin-2
biggM:M_copre2
seedM:M_cpd25539
secondary/obsolete/fantasy identifier