Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402477
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1)C(=O)CC(C2)(C)C)OCC1CCCO1
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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 C24H29NO4 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO4/c1-15-20(23(27)29-14-17-10-7-11-28-17)21(16-8-5-4-6-9-16)22-18(25-15)12-24(2,3)13-19(22)26/h4-6,8-9,17,21,25H,7,10-14H2,1-3H3InChIKey
SDLCLJYAVNBLEA-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CC=C3)C(=O)OCC4CCCO4
InChI=1SC24H29NO4c11520(23(27)291417107112817)21(168546916)2218(2515)1224(23)1319(22)26h4689172125H71014H213H3
MFCD01529759
oxolan2ylmethyl277trimethyl5oxo4phenyl1468tetrahydroquinoline3carboxylate
tetrahydrofuran2ylmethyl277trimethyl5oxo4phenyl145678hexahydroquinoline3carboxylate
ZINC000100557250
ZINC000100557259
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