Vitas-M small molecule compound
ethyl 2-amino-4',4',6'-trimethyl-2',5-dioxo-6'-phenyl-5,5',6,6',7,8-hexahydro-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carboxylate
Catalog ID
STK210056
SMILES CCOC(=O)C1=C(N)OC2=C(C31c1cccc4c1N(C3=O)C(C)(C)CC4(C)c1ccccc1)C(=O)CCC2
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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 C31H32N2O5 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O5/c1-5-37-27(35)24-26(32)38-22-16-10-15-21(34)23(22)31(24)20-14-9-13-19-25(20)33(28(31)36)29(2,3)17-30(19,4)18-11-7-6-8-12-18/h6-9,11-14H,5,10,15-17,32H2,1-4H3InChIKey
JBWSQPIYTRZHBV-UHFFFAOYSA-NSynonyms
878973-42-3878973423
CCOC(=O)C1=C(OC2=C(C13C4=CC=CC5=C4N(C3=O)C(CC5(C)C6=CC=CC=C6)(C)C)C(=O)CCC2)N
ethyl2amino446trimethyl25dioxo6phenyl24556678octahydrospiro(chromene41pyrrolo(321ij)quinoline)3carboxylate
ethyl2amino446trimethyl25dioxo6phenyl556678hexahydro4Hspiro(chromene41pyrrolo(321ij)quinoline)3carboxylate
InChI=1SC31H32N2O5c153727(35)2426(32)382216101521(34)23(22)31(24)20149131925(20)33(28(31)36)29(23)1730(194)18117681218h691114H510151732H214H3
MFCD05843915
ZINC000002441270
ZINC000002441275
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