Vitas-M small molecule compound
2-{[(3-hydroxypropyl)ammonio]methyl}-4-methyl-6-oxo-6H-benzo[c]chromen-3-olate
Catalog ID
STK620840
SMILES OCCC[NH2+]Cc1cc2c(c(c1[O-])C)oc(=O)c1c2cccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-11-16(21)12(10-19-7-4-8-20)9-15-13-5-2-3-6-14(13)18(22)23-17(11)15/h2-3,5-6,9,19-21H,4,7-8,10H2,1H3InChIKey
UZWTXLMBAWGUNX-UHFFFAOYSA-NSynonyms
2(((3hydroxypropyl)ammonio)methyl)4methyl6oxo6Hbenzo(c)chromen3olate
3hydroxy2((3hydroxypropylamino)methyl)4methylbenzo(c)chromen6one
CC1=C2C(=CC(=C1O)CNCCCO)C3=CC=CC=C3C(=O)O2
InChI=1SC18H19NO4c11116(21)12(101974820)91513523614(13)18(22)2317(11)15h235691921H47810H21H3
MFCD08749920
OCCC(NH2+)Cc1cc2c(c(c1(O))C)oc(=O)c1c2cccc1
ZINC000013653500
ZINC13653500
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