Vitas-M small molecule compound

2-phenylethyl 4-[2-(benzyloxy)phenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK363720
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CC(C2)c1ccccc1)OCCc1ccccc1

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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 C38H35NO4 MW 569.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H35NO4/c1-26-35(38(41)42-22-21-27-13-5-2-6-14-27)36(31-19-11-12-20-34(31)43-25-28-15-7-3-8-16-28)37-32(39-26)23-30(24-33(37)40)29-17-9-4-10-18-29/h2-20,30,36,39H,21-25H2,1H3
InChIKey
UWDIUZFHZKBKAN-UHFFFAOYSA-N
Synonyms

2phenylethyl2methyl5oxo7phenyl4(2phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
2phenylethyl4(2(benzyloxy)phenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4OCC5=CC=CC=C5)C(=O)OCCC6=CC=CC=C6
InChI=1SC38H35NO4c12635(38(41)42222127135261427)36(311911122034(31)432528157381628)3732(3926)2330(2433(37)40)291794101829h220303639H2125H21H3
MFCD01590165
ZINC000002925781
ZINC000002925798

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Available files

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