Vitas-M small molecule compound
4-(phenylcarbonyl)phenyl (6aS,6bR,9aS,10R)-8-(4-methylphenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Catalog ID
STK545584
SMILES O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1)C)Oc1ccc(cc1)C(=O)c1ccccc1
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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 C35H26N2O5 MW 554.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H26N2O5/c1-21-11-16-25(17-12-21)36-33(39)29-28-20-15-22-7-5-6-10-27(22)37(28)31(30(29)34(36)40)35(41)42-26-18-13-24(14-19-26)32(38)23-8-3-2-4-9-23/h2-20,28-31H,1H3/t28-,29-,30-,31+/m0/s1InChIKey
PJHKRLHBTVOJJD-XHPANXIASA-NSynonyms
(6aS6bR9aS10R)4benzoylphenyl79dioxo8(ptolyl)6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
4(phenylcarbonyl)phenyl(6aS6bR9aS10R)8(4methylphenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
CC1=CC=C(C=C1)N2C(=O)C3C4C=CC5=CC=CC=C5N4C(C3C2=O)C(=O)OC6=CC=C(C=C6)C(=O)C7=CC=CC=C7
InChI=1SC35H26N2O5c121111625(171221)3633(39)29282015227561027(22)37(28)31(30(29)34(36)40)35(41)4226181324(141926)32(38)238324923h2202831H1H3t28293031+m0s1
MFCD18242228
O=C((C@H)1(C@@H)2(C@H)((C@H)3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1)C)Oc1ccc(cc1)C(=O)c1ccccc1
ZINC000102441970
ZINC102441970
Check stock
See real-time availability and sample size for STK545584 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.