Vitas-M small molecule compound
(6aS,6bR,9aS,10R)-8-(4-butoxyphenyl)-10-[(4-methoxyphenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK540310
SMILES CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1ccc(cc1)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 C32H30N2O5 MW 522.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O5/c1-3-4-19-39-24-16-12-22(13-17-24)33-31(36)27-26-18-11-20-7-5-6-8-25(20)34(26)29(28(27)32(33)37)30(35)21-9-14-23(38-2)15-10-21/h5-18,26-29H,3-4,19H2,1-2H3/t26-,27-,28-,29+/m0/s1InChIKey
BDSVQQLEKYFQOC-XFTNXAEASA-NSynonyms
448192-25-4(6aS6bR9aS10R)8(4butoxyphenyl)10((4methoxyphenyl)carbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aS6bR9aS10R)8(4butoxyphenyl)10(4methoxybenzoyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
448192254
CCCCOC1=CC=C(C=C1)N2C(=O)C3C4C=CC5=CC=CC=C5N4C(C3C2=O)C(=O)C6=CC=C(C=C6)OC
CCCCOc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)(N1(C@H)2C=Cc2c1cccc2)C(=O)c1ccc(cc1)OC
InChI=1SC32H30N2O5c134193924161222(131724)3331(36)2726181120756825(20)34(26)29(28(27)32(33)37)30(35)2191423(382)151021h5182629H3419H212H3t26272829+m0s1
MFCD18241817
ZINC000100818322
ZINC100818322
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.