Vitas-M small molecule compound
prop-2-en-1-yl 4-(3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK086567
SMILES C=CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)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 C23H27NO4 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4/c1-6-10-28-22(26)19-14(2)24-17-12-23(3,4)13-18(25)21(17)20(19)15-8-7-9-16(11-15)27-5/h6-9,11,20,24H,1,10,12-13H2,2-5H3InChIKey
UMUARLXPRSZNEU-UHFFFAOYSA-NSynonyms
299949-03-4299949034
C=CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)OC)C(=O)CC(C2)(C)C
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=CC=C3)OC)C(=O)OCC=C
InChI=1SC23H27NO4c16102822(26)1914(2)24171223(34)1318(25)21(17)20(19)1587916(1115)275h69112024H1101213H225H3
MFCD00753384
prop2en1yl4(3methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
prop2enyl4(3methoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK086567
ZINC000002055481
ZINC000002055482
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