Vitas-M small molecule compound
3-[(3E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-1-ethyl-3-hydroxy-1,3-dihydro-2H-indol-2-one
Catalog ID
STK073573
SMILES CCN1c2ccccc2C(C1=O)(O)CC(=O)/C=C/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 C21H19NO5 MW 365.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO5/c1-2-22-17-6-4-3-5-16(17)21(25,20(22)24)12-15(23)9-7-14-8-10-18-19(11-14)27-13-26-18/h3-11,25H,2,12-13H2,1H3/b9-7+InChIKey
MVYYHXDGYFFMIB-VQHVLOKHSA-NSynonyms
356081-59-93((3E)4(13BENZODIOXOL5YL)2OXOBUT3EN1YL)1ETHYL3HYDROXY13DIHYDRO2HINDOL2ONE
3((E)4(13BENZODIOXOL5YL)2OXOBUT3ENYL)1ETHYL3HYDROXYINDOL2ONE
356081599
CCN1C2=CC=CC=C2C(C1=O)(CC(=O)C=CC3=CC4=C(C=C3)OCO4)O
CCN1c2ccccc2C(C1=O)(O)CC(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC21H19NO5c122217643516(17)21(2520(22)24)1215(23)97148101819(1114)27132618h31125H21213H21H3b97+
MFCD08086065
STK073573
ZINC000001133972
ZINC000001133974
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