1-(4-amino-2-methylpyrimid-5-ylmethyl)-3-(β-hydroxyethyl)-2-methylpyridinium

Chemical Formula:

C₁₄H₁₉N₄O

Molecular Weight:

259.33 Daltons

Monoisotopic Mass:

259.15588625280003 Daltons

SMILES:

CC1(C(CCO)=CC=C[N+]=1CC2(C(=NC(=NC=2)C)N))

InChI:

1S/C14H19N4O/c1-10-12(5-7-19)4-3-6-18(10)9-13-8-16-11(2)17-14(13)15/h3-4,6,8,19H,5,7,9H2,1-2H3,(H2,15,16,17)/q+1

InChIKey:

PZWYDZMWPANLMB-UHFFFAOYSA-N

Databases

MetaCyc: CPD-13586

KEGG: C21111

PubChem (CID): 10803

ChEBI: 72290

RefMet: Pyrithiamine

Seed: cpd23943

MetaNetX: MNXM130117