Vitas-M small molecule compound

propyl 4-(2,4-dimethoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK051012
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1OC)OC)C(=O)CC(C2)c1ccc(c(c1)OC)OC

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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 C30H35NO7 MW 521.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO7/c1-7-12-38-30(33)27-17(2)31-22-13-19(18-8-11-24(35-4)26(15-18)37-6)14-23(32)29(22)28(27)21-10-9-20(34-3)16-25(21)36-5/h8-11,15-16,19,28,31H,7,12-14H2,1-6H3
InChIKey
HBWPLFWUDXKHBH-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1OC)OC)C(=O)CC(C2)c1ccc(c(c1)OC)OC
CCCOC(=O)C1=C(NC2=C(C1C3=C(C=C(C=C3)OC)OC)C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)C
InChI=1SC30H35NO7c17123830(33)2717(2)31221319(1881124(354)26(1518)376)1423(32)29(22)28(27)2110920(343)1625(21)365h8111516192831H71214H216H3
MFCD02224209
propyl4(24dimethoxyphenyl)7(34dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl4(24dimethoxyphenyl)7(34dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK051012
ZINC000002072871
ZINC000002072874

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.