Vitas-M small molecule compound
N-{2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-beta-alanine
Catalog ID
STL460771
SMILES CC(C(=O)NCCC(=O)O)Oc1ccc2c(c1C)oc(=O)c(c2C)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 C18H21NO6 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO6/c1-9-10(2)18(23)25-16-11(3)14(6-5-13(9)16)24-12(4)17(22)19-8-7-15(20)21/h5-6,12H,7-8H2,1-4H3,(H,19,22)(H,20,21)InChIKey
GDFVDVBEXAIGBX-UHFFFAOYSA-NSynonyms
858756-88-43(2((348trimethyl2oxo2Hchromen7yl)oxy)propanamido)propanoicacid
3(2(348TRIMETHYL2OXOCHROMEN7YL)OXYPROPANOYLAMINO)PROPANOICACID
858756884
CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NCCC(=O)O)C
InChI=1SC18H21NO6c1910(2)18(23)251611(3)14(6513(9)16)2412(4)17(22)198715(20)21h5612H78H214H3(H1922)(H2021)
MFCD04142527
N(2((348trimethyl2oxo2Hchromen7yl)oxy)propanoyl)betaalanine
ZINC000002097132
ZINC000002097134
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