Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK104221
SMILES Cc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)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 C28H31NO6 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO6/c1-15-7-8-22-18(10-15)26(31)19(14-34-22)24-23(27(32)35-13-17-6-5-9-33-17)16(2)29-20-11-28(3,4)12-21(30)25(20)24/h7-8,10,14,17,24,29H,5-6,9,11-13H2,1-4H3InChIKey
RFIFEDNHPJIVER-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)(C)C)NC(=C3C(=O)OCC5CCCO5)C
InChI=1SC28H31NO6c115782218(1015)26(31)19(143422)2423(27(32)3513176593317)16(2)29201128(34)1221(30)25(20)24h781014172429H5691113H214H3
MFCD02104445
oxolan2ylmethyl277trimethyl4(6methyl4oxochromen3yl)5oxo1468tetrahydroquinoline3carboxylate
tetrahydrofuran2ylmethyl277trimethyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
ZINC000005226154
ZINC000005226168
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