Mecobalamin [USAN:INN:BAN:JAN]
carbanide;cobalt(3+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2S)-1-[3-[(1R,2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-id-3-yl]propanoylamino]propan-2-yl] phosphate
Molecular Identity
Mecobalamin [USAN:INN:BAN:JAN]
carbanide;cobalt(3+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2S)-1-[3-[(1R,2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-id-3-yl]propanoylamino]propan-2-yl] phosphate
PubChem CID: 73415798
2D Structure
Properties
C63H91CoN13O14P
Molecular Formula
1344.40
Molecular Weight
g/mol
1343.5878
Exact Mass
Da
452
TPSA
May have limited oral absorption
9
H-Bond Donors
20
H-Bond Acceptors
3140
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Mecobalamin [USAN:INN:BAN:JAN]Mecobalamin (USAN:INN:BAN:JAN)RefChem:1088902MethycobalMethyl b12methylcobalaminBR1SN1JS2WMecobalaminMethyl vitamin B12MecobalamineCobametCobametinVancominMethyl-B12Mecobalamina
Data from PubChem (NCBI)
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