Vitas-M small molecule compound
9-(5-ethylthiophen-2-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK434016
SMILES CCc1ccc(s1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)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 C23H28O3S MW 384.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28O3S/c1-6-13-7-8-18(27-13)21-19-14(24)9-22(2,3)11-16(19)26-17-12-23(4,5)10-15(25)20(17)21/h7-8,21H,6,9-12H2,1-5H3InChIKey
PRIRWIBMRCWAPE-UHFFFAOYSA-NSynonyms
9(5ethylthiophen2yl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(5ethylthiophen2yl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CCC1=CC=C(S1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C
InChI=1SC23H28O3Sc16137818(2713)211914(24)922(23)1116(19)26171223(45)1015(25)20(17)21h7821H6912H215H3
MFCD01118499
ZINC000005471496
ZINC05471496
ZINC5471496
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