Vitas-M small molecule compound
cyclohexyl 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
STK002741
SMILES Cc1ccc2c(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 C29H33NO5 MW 475.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO5/c1-16-10-11-23-19(12-16)27(32)20(15-34-23)25-24(28(33)35-18-8-6-5-7-9-18)17(2)30-21-13-29(3,4)14-22(31)26(21)25/h10-12,15,18,25,30H,5-9,13-14H2,1-4H3InChIKey
NKSCXPSHPDHKLF-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)(C)C)NC(=C3C(=O)OC5CCCCC5)C
Cc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
cyclohexyl277trimethyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
cyclohexyl277trimethyl4(6methyl4oxochromen3yl)5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC29H33NO5c11610112319(1216)27(32)20(153423)2524(28(33)35188657918)17(2)30211329(34)1422(31)26(21)25h101215182530H591314H214H3
MFCD02104515
STK002741
ZINC000008854806
ZINC000008854807
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