Vitas-M small molecule compound
ethyl (6aR,6bS,9aR,10S)-8-(2,5-dimethoxyphenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Catalog ID
STK536701
SMILES CCOC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccc3c(c1C=C2)cccc3)c1cc(OC)ccc1OC
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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 C29H26N2O6 MW 498.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O6/c1-4-37-29(34)26-25-24(27(32)31(28(25)33)22-15-17(35-2)10-14-23(22)36-3)21-13-11-19-18-8-6-5-7-16(18)9-12-20(19)30(21)26/h5-15,21,24-26H,4H2,1-3H3/t21-,24-,25-,26+/m1/s1InChIKey
ASLWNYVRNCTZOP-MYCYEZBNSA-NSynonyms
(8aR8bS11aR12S)ethyl10(25dimethoxyphenyl)911dioxo8b9101111a12hexahydro8aHbenzo(f)pyrrolo(3434)pyrrolo(12a)quinoline12carboxylate
CCOC(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1c1ccc3c(c1C=C2)cccc3)c1cc(OC)ccc1OC
CCOC(=O)C1C2C(C3N1C4=C(C=C3)C5=CC=CC=C5C=C4)C(=O)N(C2=O)C6=C(C=CC(=C6)OC)OC
ethyl(6aR6bS9aR10S)8(25dimethoxyphenyl)79dioxo6b7899a10hexahydro6aHbenzo(f)pyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
InChI=1SC29H26N2O6c143729(34)262524(27(32)31(28(25)33)221517(352)101423(22)363)2113111918865716(18)91220(19)30(21)26h515212426H4H213H3t21242526+m1s1
MFCD18241670
ZINC000035946020
ZINC35946020
Check stock
See real-time availability and sample size for STK536701 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.