Vitas-M small molecule compound
propan-2-yl 4-(4-ethoxy-3-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK002588
SMILES CCOc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccc(cc2)OC)NC(=C1C(=O)OC(C)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 C30H35NO6 MW 505.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO6/c1-7-36-25-13-10-20(16-26(25)35-6)28-27(30(33)37-17(2)3)18(4)31-23-14-21(15-24(32)29(23)28)19-8-11-22(34-5)12-9-19/h8-13,16-17,21,28,31H,7,14-15H2,1-6H3InChIKey
QDQPXRYDOBNTDB-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC(=C2C(=O)OC(C)C)C)OC
CCOc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccc(cc2)OC)NC(=C1C(=O)OC(C)C)C
InChI=1SC30H35NO6c173625131020(1626(25)356)2827(30(33)3717(2)3)18(4)31231421(1524(32)29(23)28)1981122(345)12919h8131617212831H71415H216H3
MFCD01445748
propan2yl4(4ethoxy3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propan2yl4(4ethoxy3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK002588
ZINC000004067906
ZINC000004067909
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