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

5-hydroxybenzimidazolylcob(I)amide

MNXM729159 is deprecated and here replaced by MNXM1377948
!!! Alternative mappings exist !!!
PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1377948 Image of MNXM1377948 Image of MNXM1377948
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC60H85CoN13O15P
charge0
mass1318.322
referencechebi:17679
InChIKeyCZOAGDFHXVBGHF-NCVPRIERSA-M
InChIInChI=1S/C60H86N13O15P.Co/c1-28(87-89(84,85)88-51-39(26-74)86-55(50(51)83)73-27-68-37-20-31(75)10-14-38(37)73)25-67-47(82)18-19-57(6)35(21-44(64)79)54-60(9)59(8,24-46(66)81)34(13-17-43(63)78)49(72-60)30(3)53-58(7,23-45(65)80)32(11-15-41(61)76)36(69-53)22-40-56(4,5)33(12-16-42(62)77)48(70-40)29(2)52(57)71-54;/h10,14,20,22,27-28,32-35,39,50-51,54-55,74,83H,11-13,15-19,21,23-26H2,1-9H3,(H16,61,62,63,64,65,66,67,69,70,71,72,75,76,77,78,79,80,81,82,84,85);/q;+1/p-1/t28-,32-,33-,34-,35+,39-,50-,51-,54-,55+,57-,58+,59+,60+;/m1./s1
SMILES[CH3:1][C@H:28]([CH2:25][N:67]=[C:47]([CH2:18][CH2:19][C@:57]1([CH3:6])[C@@H:35]([CH2:21][C:44](=[NH:64])[OH:79])[C@@H:54]2[C@@:60]3([CH3:9])[C@@:59]([CH3:8])([CH2:24][C:46](=[NH:66])[OH:81])[C@H:34]([CH2:13][CH2:17][C:43](=[NH:63])[OH:78])[C:49](=[C:30]([CH3:3])[C:53]4=[N:69][C:36](=[CH:22][C:40]5=[N:70][C:48](=[C:29]([CH3:2])[C:52]1=[N:71]2)[C@@H:33]([CH2:12][CH2:16][C:42](=[NH:62])[OH:77])[C:56]5([CH3:4])[CH3:5])[C@@H:32]([CH2:11][CH2:15][C:41](=[NH:61])[OH:76])[C@:58]4([CH3:7])[CH2:23][C:45](=[NH:65])[OH:80])[NH:72]3)[OH:82])[O:87][P:89]([OH:84])(=[O:85])[O:88][C@@H:51]1[C@@H:39]([CH2:26][OH:74])[O:86][C@H:55]([n+:73]2[cH:27][nH:68][c:37]3[cH:20][c:31]([O-:75])[cH:10][cH:14][c:38]32)[C@@H:50]1[OH:83].[Co+:90]
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:17679
chebi:17679 		5-hydroxybenzimidazolylcob(I)amide
5-Hydroxybenzimidazolylcob(I)amide
5-hydroxybenzimidazolylcobamide
kegg.compound:C04054
keggC:C04054 		5-Hydroxybenzimidazolylcob(I)amide
CHEBI:60494
chebi:60494 		5-hydroxybenzimidazolylcob(I)amide
5-hydroxybenzimidazolylcob(I)amide(1-)
chebi:12135
chebi:20580
chebi:2067
keggC:M_C04054 		secondary/obsolete/fantasy identifier