Vitas-M small molecule compound
9-{3-ethoxy-4-[(2-fluorobenzyl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK742154
SMILES CCOc1cc(ccc1OCc1ccccc1F)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 C32H35FO5 MW 518.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35FO5/c1-6-36-25-13-19(11-12-24(25)37-18-20-9-7-8-10-21(20)33)28-29-22(34)14-31(2,3)16-26(29)38-27-17-32(4,5)15-23(35)30(27)28/h7-13,28H,6,14-18H2,1-5H3InChIKey
UOJVUTLJVRMMPS-UHFFFAOYSA-NSynonyms
9(3ethoxy4((2fluorobenzyl)oxy)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(3ethoxy4((2fluorophenyl)methoxy)phenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C)OCC5=CC=CC=C5F
InChI=1SC32H35FO5c1636251319(111224(25)3718209781021(20)33)282922(34)1431(23)1626(29)38271732(45)1523(35)30(27)28h71328H61418H215H3
MFCD01572666
ZINC000002190003
ZINC02190003
ZINC2190003
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