Vitas-M small molecule compound

1'-(2,2-dimethylpropanoyl)-2'-(2,3,4-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STK566854
SMILES COc1ccc(c(c1OC)OC)C1C(N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

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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 C34H33NO6 MW 551.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33NO6/c1-33(2,3)32(38)27-26(22-16-17-24(39-4)29(41-6)28(22)40-5)34(30(36)20-12-8-9-13-21(20)31(34)37)25-18-15-19-11-7-10-14-23(19)35(25)27/h7-18,25-27H,1-6H3
InChIKey
QRUFAXIIHOEYMN-UHFFFAOYSA-N
Synonyms

(1R2R)1pivaloyl2(234trimethoxyphenyl)23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
1(22dimethylpropanoyl)2(234trimethoxyphenyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
1(22DIMETHYLPROPANOYL)2(234TRIMETHOXYPHENYL)SPIRO(23ADIHYDRO1HPYRROLO(12A)QUINOLINE32INDENE)13DIONE
CC(C)(C)C(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C(=O)C5=CC=CC=C5C2=O)C6=C(C(=C(C=C6)OC)OC)OC
COc1ccc(c(c1OC)OC)(C@H)1(C@@H)(N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C
InChI=1SC34H33NO6c133(23)32(38)2726(22161724(394)29(416)28(22)405)34(30(36)2012891321(20)31(34)37)25181519117101423(19)35(25)27h7182527H16H3
MFCD05732498
ZINC000001298681
ZINC000229927506

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.