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Co-precorrin-4

PropertiesImageOccurences in reactions
MNX_IDMNXM732833Image of MNXM732833
#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 4
formulaC44H43CoN4O16
charge-7
mass942.773
referencechebi:60061
InChIKeyVHHGJROBFDFFAE-QTESGACZSA-F
InChIInChI=1S/C44H51N4O16.Co/c1-20-44-40-25(14-37(59)60)41(2,12-11-35(55)56)30(47-40)16-27-21(5-8-32(49)50)22(13-36(57)58)26(45-27)15-28-23(6-9-33(51)52)42(3,18-38(61)62)31(46-28)17-29(48-44)24(7-10-34(53)54)43(44,4)19-39(63)64-20;/h15,17,20,23-24H,5-14,16,18-19H2,1-4H3,(H8,46,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62);/q-1;+2/p-8/b28-15-;/t20?,23-,24-,41-,42+,43+,44?;/m1./s1
SMILES[CH3:1][CH:20]1[C:44]23[C:40]4=[C:25]([CH2:14][C:37](=[O:59])[OH:60])[C@@:41]([CH3:2])([CH2:12][CH2:11][C:35](=[O:55])[OH:56])[C:30](=[N:47]4)[CH2:16][c:27]4[c:21]([CH2:5][CH2:8][C:32](=[O:49])[OH:50])[c:22]([CH2:13][C:36](=[O:57])[OH:58])[c:26]([n-:45]4)/[CH:15]=[C:28]4/[C@@H:23]([CH2:6][CH2:9][C:33](=[O:51])[OH:52])[C@:42]([CH3:3])([CH2:18][C:38](=[O:61])[OH:62])[C:31](=[NH+:46]4)[CH:17]=[C:29]([C@@H:24]([CH2:7][CH2:10][C:34](=[O:53])[OH:54])[C@:43]2([CH3:4])[CH2:19][C:39](=[O:63])[O:64]1)[N-:48]3.[Co+2:65]
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:60061
chebi:60061 		Co-precorrin-4
3,3',3'',3'''-{[(2S,3S,7S,11S,17R)-1-(1-hydroxyethyl)-2,7,12,18-tetrakis(carboxymethyl)-2,7,17-trimethyl-18,19-didehydrocorrin-3,8,13,17-kappa(4)N(21),N(22),N(23),N(24)]tetrapropanoato(9-)}cobaltate(5-) 1(1),2(1)-delta-lactone
cobalt-precorrin-4 pentaanion
cobalt-precorrin-4(7-)
bigg.metabolite:copre4
biggM:copre4
kegg.compound:C11540
keggC:C11540 		Cobalt-precorrin 4
seed.compound:cpd08370
seedM:cpd08370 		Cobalt-precorrin 4
cobalt-precorrin 4
cobalt-precorrin-4
copre4
vmhM:copre4
vmhmetabolite:copre4 		cobalt-precorrin 4
metacyc.compound:CPD-9041
metacycM:CPD-9041 		cobalt-precorrin-4
CHEBI:3792
chebi:3792 		cobalt-precorrin-4
Cobalt-precorrin 4
biggM:M_copre4
keggC:M_C11540
seedM:M_cpd08370 		secondary/obsolete/fantasy identifier