Vitas-M small molecule compound

2-ethoxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK051132
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)O)OC)C(=O)CC(C2)(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 C24H31NO6 MW 429.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO6/c1-6-30-9-10-31-23(28)20-14(2)25-16-12-24(3,4)13-18(27)22(16)21(20)15-7-8-19(29-5)17(26)11-15/h7-8,11,21,25-26H,6,9-10,12-13H2,1-5H3
InChIKey
ZHSRUSMLCHYICW-UHFFFAOYSA-N
Synonyms

2ethoxyethyl4(3hydroxy4methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl4(3hydroxy4methoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)O)OC)C(=O)CC(C2)(C)C
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)O)C(=O)CC(C2)(C)C)C
InChI=1SC24H31NO6c16309103123(28)2014(2)25161224(34)1318(27)22(16)21(20)157819(295)17(26)1115h7811212526H69101213H215H3
MFCD01814415
STK051132
ZINC000002784286
ZINC000018128075

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Available files

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