**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

[Methionine synthase]-cob(II)alamin

Properties Image MNX_ID MNXM732142 reference keggC:C06409 formula C69H97CoN17O16P*2 global charge 1 mol weight   InChIKey   InChI   SMILES [*]NC(=O)[C@H](Cc1cnc[nH]1)NC([*])=O.C/C1=C2/N([Co+])C([C@H](CC(N)=O)[C@@]2(C)CCC(=O)NC[C@@H](C)OP(=O)(O)O[C@H]2[C@@H](O)[C@@H](n3cnc4cc(C)c(C)cc43)O[C@@H]2CO)[C@]2(C)N=C(/C(C)=C3\N=C(/C=C4\N=C1[C@@H](CCC(N)=O)C4(C)C)[C@@H](CCC(N)=O)[C@]3(C)CC(N)=O)[C@@H](CCC(N)=O)[C@]2(C)CC(N)=O MNX internals InChI (mnx) InChI=1/C62H90N13O14P.C9H14N4O2.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;1-6(14)13-8(9(15)10-2)3-7-4-11-5-12-7;/h20-21,23,28,31,34-37,41,52-53,56-57,73,76,84H,12-19,22,24-27H2,1-11H3,(H2,63,77)(H2,64,78)(H2,65,79)(H2,66,80)(H2,67,81)(H2,68,82)(H,69,83)(H,85,86);4-5,8H,3H2,1-2H3,(H,10,15)(H,11,12)(H,13,14);/q;;+2/b42-23-,54-32-,55-33-;;/t31-,34-,35-,36-,37+,41-,52-,53-,56?,57+,59-,60+,61+,62+;8-;/m10./s1/i;1+1,2+1; SMILES (mnx) [13C@@H:91]([13CH2:92][C:95]1=[CH:99][O:104]=[O:105][NH:100]1)([C:93]([CH2:96][NH2:101])=[CH2:97])[CH2:94][C:98](=[NH:102])[NH2:103].[CH:1]1=[C:6]2[C@@H:15]([CH2:27][CH2:41][C:51]([CH3:62])=[NH:63])[C@:13]([CH2:25][C:40]([CH3:49])=[CH2:50])([CH3:26])[C@:5]1([CH3:14])[CH:7]1[CH2:2]/[C:8](=[C:19](/[CH3:32])[C:11]3=[CH:4]/[C:12](=[CH:22]/[C:10]4=[CH:3]/[C:9](=[C:16]/2[CH3:28])[C@@:20]([CH2:33][C:44]([CH3:55])=[CH2:56])([CH3:34])[C@@H:21]4[CH2:35][CH2:45][C:57]([NH2:66])=[NH:67])[C:24]([CH3:37])([CH3:38])[C@@H:23]3[CH2:36][CH2:46][C:58]([NH2:68])=[NH:69])[C@@:18]([CH2:30][CH2:43][C:54]([NH:64][NH:72][N:75]([O:76][N:73]([NH:70][C@@H:59]2[CH:47]([CH3:60])[C@@H:39]([O:80]3[O:81]4=[O:82]([O:83]=[O:84]3)[O:88]=[O:87]([PH2:90])[O:86]([OH:89])=[O:85]4)[CH2:48][C@@H:61]2[NH:71][NH2:74])([OH:77])=[O:78])[OH:79])=[NH:65])([CH3:31])[C@H:17]1[CH2:29][C:42]([CH3:52])=[CH2:53].[Co+2:106]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
kegg.compound:C06409 keggC:C06409	[Methionine synthase]-cob(II)alamin
keggC:M_C06409	secondary/obsolete/fantasy identifier