Vitas-M small molecule compound
(6aS,6bR,9aS,10R)-N-(2,5-dimethoxyphenyl)-7,9-dioxo-8-phenyl-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Catalog ID
STK558109
SMILES COc1ccc(c(c1)NC(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1)C=Cc1c2cccc1)OC
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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 C29H25N3O5 MW 495.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O5/c1-36-19-13-15-23(37-2)20(16-19)30-27(33)26-25-24(22-14-12-17-8-6-7-11-21(17)32(22)26)28(34)31(29(25)35)18-9-4-3-5-10-18/h3-16,22,24-26H,1-2H3,(H,30,33)/t22-,24-,25-,26+/m0/s1InChIKey
RDPTVCKMOMNUHL-ZCLKUGBOSA-NSynonyms
1014083-52-3(6aS6bR9aS10R)N(25dimethoxyphenyl)79dioxo8phenyl6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxamide
1014083523
COC1=CC(=C(C=C1)OC)NC(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC=CC=C6
COc1ccc(c(c1)NC(=O)(C@@H)1N2(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1ccccc1)C=Cc1c2cccc1)OC
InChI=1SC29H25N3O5c13619131523(372)20(1619)3027(33)262524(221412178671121(17)32(22)26)28(34)31(29(25)35)1894351018h316222426H12H3(H3033)t22242526+m0s1
MFCD18243064
ZINC000101084409
ZINC101084409
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