MetaADEDB 2.0 @ LMMD
Vitamin B 12
(FEZWOUWWJOYMLT-DSRCUDDDSA-L)
Structure
SMILES
OC[C@H]1O[C@@H]([C@@H]([C@@H]1OP(=O)(O[C@@H](CNC(=O)CC[C@@]1(C)/C/2=C(\C)/C3=N/C(=C\C4=N/C(=C(\C5=N[C@]([C@@H]([C@@H]1CC(=O)N)[N-]2)(C)[C@@](C)(CC(=O)N)[C@@H]5CCC(=O)N)/C)/[C@@]([C@@H]4CCC(=O)N)(C)CC(=O)N)/C([C@@H]3CCC(=O)N)(C)C)C)[O-])O)n1cnc2c1cc(C)c(c2)C.[Co]
Molecular Formula:
C62H88CoN13O14P--
Molecular Weight:
1329.350
Log P:
6.6155
Hydrogen Bond Acceptor:
26
Hydrogen Bond Donor:
9
TPSA:
460.63
CAS Number(s):
13408-78-1; 14463-33-3; 18534-66-2
Synonym(s)
1.
Vitamin B 12
2.
Cobalamin
3.
Cyanocobalamin
4.
Cobalamins
5.
Eritron
6.
Vitamin B12
7.
B 12, Vitamin
8.
B12, Vitamin
External Link(s)
Adverse Drug Event(s)
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