Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-N-(4-methoxybenzyl)propanamide
Catalog ID
STL435068
SMILES COc1ccc(cc1)CNC(=O)CC(c1c(=O)oc2c(c1O)cccc2)c1ccc2c(c1)OCO2
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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 C27H23NO7 MW 473.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO7/c1-32-18-9-6-16(7-10-18)14-28-24(29)13-20(17-8-11-22-23(12-17)34-15-33-22)25-26(30)19-4-2-3-5-21(19)35-27(25)31/h2-12,20,30H,13-15H2,1H3,(H,28,29)InChIKey
WEKWKDYKDNEUQZ-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)3(4hydroxy2oxo2Hchromen3yl)N(4methoxybenzyl)propanamide
3(13benzodioxol5yl)3(4hydroxy2oxochromen3yl)N((4methoxyphenyl)methyl)propanamide
COC1=CC=C(C=C1)CNC(=O)CC(C2=CC3=C(C=C2)OCO3)C4=C(C5=CC=CC=C5OC4=O)O
InChI=1SC27H23NO7c132189616(71018)142824(29)1320(178112223(1217)34153322)2526(30)19423521(19)3527(25)31h2122030H1315H21H3(H2829)
MFCD30711612
ZINC000253471621
ZINC000253471623
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