Vitas-M small molecule compound
3-cycloheptyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404708
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(c(c1)OC)O)C(=C(N2)C)C(=O)OC1CCCCCC1
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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 C28H35NO7 MW 497.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35NO7/c1-15-13-19-25(26(31)22(15)27(32)35-4)24(17-11-12-20(30)21(14-17)34-3)23(16(2)29-19)28(33)36-18-9-7-5-6-8-10-18/h11-12,14-15,18,22,24,29-30H,5-10,13H2,1-4H3InChIKey
JHOZIYWWANHHPC-UHFFFAOYSA-NSynonyms
3cycloheptyl6methyl4(4hydroxy3methoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocycloheptyl6Omethyl4(4hydroxy3methoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCCCC3)C4=CC(=C(C=C4)O)OC)C(=O)C1C(=O)OC
InChI=1SC28H35NO7c115131925(26(31)22(15)27(32)354)24(17111220(30)21(1417)343)23(16(2)2919)28(33)3618975681018h111214151822242930H51013H214H3
MFCD05031598
ZINC000020569627
ZINC000239121100
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