Vitas-M small molecule compound
prop-2-en-1-yl 4-[4-(acetyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK333828
SMILES C=CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC(=O)C)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 C24H27NO5 MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5/c1-6-11-29-23(28)20-14(2)25-18-12-24(4,5)13-19(27)22(18)21(20)16-7-9-17(10-8-16)30-15(3)26/h6-10,21,25H,1,11-13H2,2-5H3InChIKey
OLIIHJLDOYCMTD-UHFFFAOYSA-NSynonyms
299945-72-5299945725
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)OC(=O)C)C(=O)OCC=C
InChI=1SC24H27NO5c16112923(28)2014(2)25181224(45)1319(27)22(18)21(20)167917(10816)3015(3)26h6102125H11113H225H3
MFCD00752927
prop2en1yl4(4(acetyloxy)phenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
prop2enyl4(4acetyloxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
ZINC000002069368
ZINC000002069369
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