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methylcob(III)alamin

PropertiesImageOccurences in reactions
MNX_IDMNXM727391Image of MNXM727391
#reac
in my sandbox 0
in MNXref (generic)20
in models (compartimentalized) 3
formulaC63H91CoN13O14P
charge0
mass1343.5878
referencechebi:28115
InChIKeyJEWJRMKHSMTXPP-WZHZPDAFSA-L
InChIInChI=1S/C62H90N13O14P.CH3.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;;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H15,63,64,65,66,67,68,69,71,72,73,74,77,78,79,80,81,82,83,85,86);1H3;/q;;+2/p-2/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;;/m1../s1
SMILESCC1=C2[N+]3=C(C=C4[N+]5=C(C(C)=C6N7[C@@H]8[C@H](CC(N)=O)[C@@]6(C)CCC(=O)NC[C@@H](C)OP(=O)([O-])O[C@@H]6[C@@H](CO)O[C@@H]([C@@H]6O)n6c[n+](c9cc(C)c(C)cc96)[Co-3]753(C)[N+]3=C1[C@@H](CCC(N)=O)[C@](C)(CC(N)=O)[C@]83C)[C@@H](CCC(N)=O)C4(C)C)[C@@H](CCC(N)=O)[C@]2(C)CC(N)=O
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Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
reactome:R-ALL-3149508
reactomeM:R-ALL-3149508
CHEBI:28115
chebi:28115
methylcob(III)alamin
CO-METHYLCOBALAMIN
Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-methylcobamide
MeCbl
Methylcobalamin
mecobalamin
methylcobalamin
bigg.metabolite:C06453
biggM:C06453
sabiork.compound:8643
sabiorkM:8643
Methylcobalamin
hmdb:HMDB0002274 Methylcobalamin
(10S,12R,13S,17R,23R,24R,25R,30S,35S,36S,40S,41S,42R,46R)-30,35,40-tris(2-carbamoylethyl)-24,36,41-tris(carbamoylmethyl)-46-hydroxy-12-(hydroxymethyl)-1,5,6,17,23,28,31,31,36,38,41,42-dodecamethyl-15,20-dioxo-11,14,16-trioxa-2lambda5,9,19,26,43lambda5,44lambda5,45lambda5-heptaaza-15lambda5-phospha-1-cobaltadodecacyclo[27.14.1.1^{1,34}.1^{2,9}.1^{10,13}.0^{1,26}.0^{3,8}.0^{23,27}.0^{25,42}.0^{32,44}.0^{39,43}.0^{37,45}]heptatetraconta-2(47),3,5,7,27,29(44),32,34(45),37,39(43)-decaene-2,43,44,45-tetrakis(ylium)-1,1,1-triuid-15-olate
CO-METHYLCOBALAMIN
MeCbl
Mecobalamin
Methyl(III)cobalamin
Methylcob(III)alamin
kegg.compound:C06453
keggC:C06453
Methylcobalamin
Methylcob(III)alamin
seed.compound:cpd12878
seedM:cpd12878
Methylcobalamin
algobaz
cobamet
cobametin
mecobalamin
methyl cobalamine
methyl-B12
methylcob(III)alamin
methylcobalamin
vancomin
metacyc.compound:CPD-9037
metacycM:CPD-9037
methylcob(III)alamin
algobaz
cobamet
cobametin
mecobalamin
methyl cobalamine
methylcobalamin
vancomin
hmdb:HMDB02274
chebi:25291
chebi:48831
chebi:6869
biggM:M_C06453
keggC:M_C06453
seedM:M_cpd12878
secondary/obsolete/fantasy identifier