Vitas-M small molecule compound
1-[6-hydroxy-4-(3-methoxyphenyl)-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzoxazol-5-yl]ethanone
Catalog ID
STL440740
SMILES COc1cccc(c1)C1c2c(C)onc2CC(C1C(=O)C)(C)O
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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 C18H21NO4 MW 315.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4/c1-10(20)17-16(12-6-5-7-13(8-12)22-4)15-11(2)23-19-14(15)9-18(17,3)21/h5-8,16-17,21H,9H2,1-4H3InChIKey
TYPCQOQQNFKMIN-UHFFFAOYSA-NSynonyms
1(6hydroxy4(3methoxyphenyl)36dimethyl4567tetrahydro21benzoxazol5yl)ethanone
1(6HYDROXY4(3METHOXYPHENYL)36DIMETHYL57DIHYDRO4H21BENZOXAZOL5YL)ETHANONE
CC1=C2C(C(C(CC2=NO1)(C)O)C(=O)C)C3=CC(=CC=C3)OC
InChI=1SC18H21NO4c110(20)1716(1265713(812)224)1511(2)231914(15)918(173)21h58161721H9H214H3
MFCD06241200
ZINC000001414965
ZINC000005274337
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