Vitas-M small molecule compound
cyclohexyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK021257
SMILES Clc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
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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 C28H30ClNO5 MW 496.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30ClNO5/c1-15-23(27(33)35-17-7-5-4-6-8-17)24(25-20(30-15)12-28(2,3)13-21(25)31)19-14-34-22-10-9-16(29)11-18(22)26(19)32/h9-11,14,17,24,30H,4-8,12-13H2,1-3H3InChIKey
SSOMGEZICVQRMV-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OC5CCCCC5
Clc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
cyclohexyl4(6chloro4oxo4Hchromen3yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(6chloro4oxochromen3yl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC28H30ClNO5c11523(27(33)35177546817)24(2520(3015)1228(23)1321(25)31)1914342210916(29)1118(22)26(19)32h91114172430H481213H213H3
MFCD02627242
STK021257
ZINC000019907616
ZINC000019907618
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