Vitas-M small molecule compound
2-methoxy-5-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)benzyl acetate
Catalog ID
STK831714
SMILES COc1ccc(cc1COC(=O)C)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 C27H32O6 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32O6/c1-15(28)32-14-17-9-16(7-8-20(17)31-6)23-24-18(29)10-26(2,3)12-21(24)33-22-13-27(4,5)11-19(30)25(22)23/h7-9,23H,10-14H2,1-6H3InChIKey
VQMLSPAWWLNMSW-UHFFFAOYSA-NSynonyms
331465-33-9(2methoxy5(3366tetramethyl18dioxo4579tetrahydro2Hxanthen9yl)phenyl)methylacetate
2methoxy5(3366tetramethyl18dioxo23456789octahydro1Hxanthen9yl)benzylacetate
331465339
CC(=O)OCC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C)OC
InChI=1SC27H32O6c115(28)321417916(7820(17)316)232418(29)1026(23)1221(24)33221327(45)1119(30)25(22)23h7923H1014H216H3
MFCD00323369
ZINC000000710966
ZINC00710966
ZINC710966
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