Vitas-M small molecule compound
1-[4-(1,3-benzodioxol-5-yl)-6-hydroxy-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzoxazol-5-yl]ethanone
Catalog ID
STL447173
SMILES CC(=O)C1C(c2ccc3c(c2)OCO3)c2c(C)onc2CC1(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 C18H19NO5 MW 329.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO5/c1-9(20)17-16(11-4-5-13-14(6-11)23-8-22-13)15-10(2)24-19-12(15)7-18(17,3)21/h4-6,16-17,21H,7-8H2,1-3H3InChIKey
CIASOHIRSOCWGF-UHFFFAOYSA-NSynonyms
1(4(13benzodioxol5yl)6hydroxy36dimethyl4567tetrahydro21benzoxazol5yl)ethanone
1(4(13BENZODIOXOL5YL)6HYDROXY36DIMETHYL57DIHYDRO4H21BENZOXAZOL5YL)ETHANONE
CC1=C2C(C(C(CC2=NO1)(C)O)C(=O)C)C3=CC4=C(C=C3)OCO4
InChI=1SC18H19NO5c19(20)1716(11451314(611)2382213)1510(2)241912(15)718(173)21h46161721H78H213H3
MFCD06241197
ZINC000005242749
ZINC000251925389
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