Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(2,5-dimethoxyphenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK537175
SMILES COc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1ccc1c2cccc1)C(=O)c1ccccc1)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 C33H26N2O5 MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O5/c1-39-21-13-17-27(40-2)26(18-21)35-32(37)28-25-16-14-23-22-11-7-6-8-19(22)12-15-24(23)34(25)30(29(28)33(35)38)31(36)20-9-4-3-5-10-20/h3-18,25,28-30H,1-2H3/t25-,28-,29-,30+/m1/s1InChIKey
POZKOWWHOHMKCA-XDUYTMKBSA-NSynonyms
(6aR6bS9aR10S)8(25dimethoxyphenyl)10(phenylcarbonyl)9a10dihydro6aHbenzo(f)pyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(8aR8bS11aR12S)12benzoyl10(25dimethoxyphenyl)11a12dihydro8aHbenzo(f)pyrrolo(3434)pyrrolo(12a)quinoline911(8bH10H)dione
COC1=CC(=C(C=C1)OC)N2C(=O)C3C4C=CC5=C(N4C(C3C2=O)C(=O)C6=CC=CC=C6)C=CC7=CC=CC=C75
COc1ccc(c(c1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2C=Cc2c1ccc1c2cccc1)C(=O)c1ccccc1)OC
InChI=1SC33H26N2O5c13921131727(402)26(1821)3532(37)2825161423221176819(22)121524(23)34(25)30(29(28)33(35)38)31(36)2094351020h318252830H12H3t25282930+m1s1
MFCD18241679
ZINC000100762088
ZINC100762088
Check stock
See real-time availability and sample size for STK537175 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.