Vitas-M small molecule compound

2-(propan-2-yloxy)ethyl 4-[4-(methoxycarbonyl)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK402536
SMILES COC(=O)c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCCOC(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 C26H33NO6 MW 455.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO6/c1-15(2)32-11-12-33-25(30)21-16(3)27-19-13-26(4,5)14-20(28)23(19)22(21)17-7-9-18(10-8-17)24(29)31-6/h7-10,15,22,27H,11-14H2,1-6H3
InChIKey
FRAPYGKEKDYNQZ-UHFFFAOYSA-N
Synonyms
312622-94-9
2(propan2yloxy)ethyl4(4(methoxycarbonyl)phenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2propan2yloxyethyl4(4methoxycarbonylphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
312622949
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)C(=O)OC)C(=O)OCCOC(C)C
DMANNOSE346TRIOMETHYL
InChI=1SC26H33NO6c115(2)3211123325(30)2116(3)27191326(45)1420(28)23(19)22(21)177918(10817)24(29)316h710152227H1114H216H3
MFCD01825232
ZINC000002088631
ZINC000002088632

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Available files

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