Vitas-M small molecule compound

N-{2-[(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-beta-alanine

Catalog ID
STL460715
SMILES CCCCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)NCCC(=O)O)C

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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 C20H25NO6 MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO6/c1-4-5-6-14-11-18(24)27-19-12(2)16(8-7-15(14)19)26-13(3)20(25)21-10-9-17(22)23/h7-8,11,13H,4-6,9-10H2,1-3H3,(H,21,25)(H,22,23)
InChIKey
UNCCPQVPAPFZBH-UHFFFAOYSA-N
Synonyms
858757-89-8
3(2((4butyl8methyl2oxo2Hchromen7yl)oxy)propanamido)propanoicacid
3(2(4BUTYL8METHYL2OXOCHROMEN7YL)OXYPROPANOYLAMINO)PROPANOICACID
858757898
CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NCCC(=O)O
InChI=1SC20H25NO6c1456141118(24)271912(2)16(8715(14)19)2613(3)20(25)2110917(22)23h781113H46910H213H3(H2125)(H2223)
MFCD04143281
N(2((4butyl8methyl2oxo2Hchromen7yl)oxy)propanoyl)betaalanine
ZINC000002098953
ZINC000002098955

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Available files

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