Mol:BMCCPPCB0012
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
91102 0 0 1 0 0 0 0 0999 V2000
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S SKP 7
ID BMCCPPCB0012
NAME Cob(III)alamin
FORMULA C62H89CoN13O14P
EXACTMASS 1329.5721
AVERAGEMASS 1330.3562
SMILES C(N3=1)(=C(C)9)[C@](CC(=O)N)([C@H](CCC(N)=O)C1C=C(N=24)C(C)(C)[C@H](CCC(N)=O)C2C(=C([C@@]8(C)%12)N(C%11[C@H](CC(N)=O)%12)[Co+3]34(C)(N([C@@]%11(C)%10)=C9[C@@H](CCC(N)=O)[C@@]%10(C)CC(=O)N)n(c6)c(c5n6[C@H]([C@H]7O)O[C@H]([C@@H]7OP(O[C@H](C)CNC(=O)CC8)([O-1])=O)O)cc(C)c(c5)C)C)C
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05776
M END
