Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(biphenyl-4-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK007036
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(cc1)c1ccccc1)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 C30H33NO4 MW 471.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO4/c1-19-26(29(33)35-18-23-10-7-15-34-23)27(28-24(31-19)16-30(2,3)17-25(28)32)22-13-11-21(12-14-22)20-8-5-4-6-9-20/h4-6,8-9,11-14,23,27,31H,7,10,15-18H2,1-3H3InChIKey
MTWHQAGVRJHPHU-UHFFFAOYSA-NSynonyms
297157-77-8297157778
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OCC5CCCO5
InChI=1SC30H33NO4c11926(29(33)351823107153423)27(2824(3119)1630(23)1725(28)32)22131121(121422)208546920h46891114232731H7101518H213H3
MFCD01975570
O=C(C1=C(C)NC2=C(C1c1ccc(cc1)c1ccccc1)C(=O)CC(C2)(C)C)OCC1CCCO1
oxolan2ylmethyl277trimethyl5oxo4(4phenylphenyl)1468tetrahydroquinoline3carboxylate
STK007036
tetrahydrofuran2ylmethyl4(biphenyl4yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ZINC000019772454
ZINC000019772460
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