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Methionine Synthase-Methylcob(I)Alamin

PropertiesImage
MNX_IDMNXM1561001 Image of MNXM1561001
referencevmhM:M00189
vmhM:M00189
formulaC70H100CoN17O16P*2
global charge1
mol weight1525.58
InChIKey 
InChI 
SMILES[*]NC(=O)[C@H](Cc1cnc[nH]1)NC([*])=O.C[Co+]N1/C2=C(/C)C3=N/C(=C\C4=N/C(=C(/C)C5=N[C@@](C)(C1[C@H](CC(N)=O)[C@@]2(C)CCC(=O)NC[C@@H](C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H](n2cnc6cc(C)c(C)cc62)O[C@@H]1CO)[C@@](C)(CC(N)=O)[C@@H]5CCC(N)=O)[C@@](C)(CC(N)=O)[C@@H]4CCC(N)=O)C(C)(C)[C@@H]3CCC(N)=O
MNX internals
InChI (mnx)  Image of MNXM1561001
SMILES (mnx)[Co+3:106].[H][C-:107]([H])[H].[NH:1]([*:2])[C:3](=[O:4])[C@@H:5]([NH:6][C:7]([*:8])=[O:9])[CH2:10][c:11]1[cH:12][n:13][cH:14][nH:15]1.[OH:16][CH2:17][C@H:18]1[O:19][C@H:20]([n:21]2[cH:22][n:23][c:24]3[c:25]2[cH:26][c:27]([CH3:31])[c:28]([CH3:30])[cH:29]3)[C@H:32]([OH:33])[C@@H:34]1[O:35][P:36](=[O:37])([OH:38])[O:39][C@H:40]([CH3:41])[CH2:42][NH:43][C:44](=[O:45])[CH2:46][CH2:47][C@@:48]1([CH3:105])/[C:49]2=[C:50](\[CH3:104])[C:51]3=[N:52]/[C:53](=[CH:54]\[C:55]4=[N:56]/[C:57](=[C:58](/[CH3:82])[C:59]5=[N:60][C@@:61]([CH3:62])([CH:63]([NH:64]2)[C@@H:65]1[CH2:66][C:67](=[O:68])[NH2:69])[C@@:70]([CH3:71])([CH2:72][C:73](=[O:74])[NH2:75])[C@@H:76]5[CH2:77][CH2:78][C:79](=[O:80])[NH2:81])[C@@:83]([CH3:84])([CH2:85][C:86](=[O:87])[NH2:88])[C@@H:89]4[CH2:90][CH2:91][C:92](=[O:93])[NH2:94])[C:95]([CH3:96])([CH3:97])[C@@H:98]3[CH2:99][CH2:100][C:101](=[O:102])[NH2:103]
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
IdentifierDescription

vmhM:M00189
vmhM:M00189
vmhmetabolite:M00189
vmhmetabolite:M00189
Methionine Synthase-Methylcob(I)Alamin

vmhM:M_M00189
secondary/obsolete/fantasy identifier