Vitas-M small molecule compound
benzyl [2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetate
Catalog ID
STK673618
SMILES COc1cc(ccc1OCC(=O)OCc1ccccc1)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 C33H36O7 MW 544.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36O7/c1-32(2)14-22(34)30-26(16-32)40-27-17-33(3,4)15-23(35)31(27)29(30)21-11-12-24(25(13-21)37-5)38-19-28(36)39-18-20-9-7-6-8-10-20/h6-13,29H,14-19H2,1-5H3InChIKey
CNCCMOHSDYCPMP-UHFFFAOYSA-NSynonyms
benzyl(2methoxy4(3366tetramethyl18dioxo23456789octahydro1Hxanthen9yl)phenoxy)acetate
benzyl2(2methoxy4(3366tetramethyl18dioxo4579tetrahydro2Hxanthen9yl)phenoxy)acetate
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OCC(=O)OCC5=CC=CC=C5)OC)C(=O)C1)C
InChI=1SC33H36O7c132(2)1422(34)3026(1632)40271733(34)1523(35)31(27)29(30)21111224(25(1321)375)381928(36)39182097681020h61329H1419H215H3
MFCD01202736
ZINC000000713197
ZINC00713197
ZINC713197
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