Vitas-M small molecule compound

1'-acetyl-2'-(2,5-dimethoxyphenyl)-8'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STL238528
SMILES COc1ccc(c(c1)C1C(C(=O)C)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cc(C)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 C31H27NO5 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO5/c1-17-9-10-19-11-14-26-31(29(34)21-7-5-6-8-22(21)30(31)35)27(28(18(2)33)32(26)24(19)15-17)23-16-20(36-3)12-13-25(23)37-4/h5-16,26-28H,1-4H3
InChIKey
LLHHOLOFRVTWOU-UHFFFAOYSA-N
Synonyms

(1R2R)1acetyl2(25dimethoxyphenyl)8methyl23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
1acetyl2(25dimethoxyphenyl)8methyl12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
1ACETYL2(25DIMETHOXYPHENYL)8METHYLSPIRO(23ADIHYDRO1HPYRROLO(12A)QUINOLINE32INDENE)13DIONE
CC1=CC2=C(C=CC3N2C(C(C34C(=O)C5=CC=CC=C5C4=O)C6=C(C=CC(=C6)OC)OC)C(=O)C)C=C1
COc1ccc(c(c1)(C@H)1(C@H)(C(=O)C)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cc(C)cc1)OC
InChI=1SC31H27NO5c1179101911142631(29(34)21756822(21)30(31)35)27(28(18(2)33)32(26)24(19)1517)231620(363)121325(23)374h5162628H14H3
MFCD24858821
ZINC000002454371
ZINC000033795743

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Available files

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