Vitas-M small molecule compound
dibenzyl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STK774385
SMILES COc1cc(ccc1O)C1C(C(=O)OCc2ccccc2)C(=O)CC(C1C(=O)OCc1ccccc1)(C)O
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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 C30H30O8 MW 518.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30O8/c1-30(35)16-23(32)26(28(33)37-17-19-9-5-3-6-10-19)25(21-13-14-22(31)24(15-21)36-2)27(30)29(34)38-18-20-11-7-4-8-12-20/h3-15,25-27,31,35H,16-18H2,1-2H3InChIKey
IFDAJMORJMNCKW-UHFFFAOYSA-NSynonyms
CC1(CC(=O)C(C(C1C(=O)OCC2=CC=CC=C2)C3=CC(=C(C=C3)O)OC)C(=O)OCC4=CC=CC=C4)O
dibenzyl4hydroxy2(4hydroxy3methoxyphenyl)4methyl6oxocyclohexane13dicarboxylate
InChI=1SC30H30O8c130(35)1623(32)26(28(33)37171995361019)25(21131422(31)24(1521)362)27(30)29(34)381820117481220h31525273135H1618H212H3
MFCD03883664
ZINC000015306699
ZINC000245238271
Check stock
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Check stock on Vitas-MAvailable files
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