Vitas-M small molecule compound
6-acetyl-5-hydroxy-4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H-chromen-2-one
Catalog ID
STL423086
SMILES CSc1ccc(cc1)C1CC(=O)Oc2c1c(O)c(cc2)C(=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 C18H16O4S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O4S/c1-10(19)13-7-8-15-17(18(13)21)14(9-16(20)22-15)11-3-5-12(23-2)6-4-11/h3-8,14,21H,9H2,1-2H3InChIKey
WYWXTMABPFZMGR-UHFFFAOYSA-NSynonyms
1630823-34-51630823345
6acetyl5hydroxy4(4(methylsulfanyl)phenyl)34dihydro2Hchromen2one
6acetyl5hydroxy4(4(methylthio)phenyl)chroman2one
6acetyl5hydroxy4(4methylsulfanylphenyl)34dihydrochromen2one
CC(=O)C1=C(C2=C(C=C1)OC(=O)CC2C3=CC=C(C=C3)SC)O
InChI=1SC18H16O4Sc110(19)13781517(18(13)21)14(916(20)2215)113512(232)6411h381421H9H212H3
MFCD28367787
ZINC000218308880
ZINC000218308926
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