Vitas-M small molecule compound

1-(carboxy{6-[(3-carboxypropanoyl)amino]-1H-indol-3-yl}methyl)piperidine-3-carboxylic acid

Catalog ID
STK647634
SMILES OC(=O)CCC(=O)Nc1ccc2c(c1)[nH]cc2C(N1CCCC(C1)C(=O)O)C(=O)O

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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 C20H23N3O7 MW 417.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O7/c24-16(5-6-17(25)26)22-12-3-4-13-14(9-21-15(13)8-12)18(20(29)30)23-7-1-2-11(10-23)19(27)28/h3-4,8-9,11,18,21H,1-2,5-7,10H2,(H,22,24)(H,25,26)(H,27,28)(H,29,30)
InChIKey
MIBVTHRQJZFVKN-UHFFFAOYSA-N
Synonyms
1144471-51-1
1(carboxy(6((3carboxypropanoyl)amino)1Hindol3yl)methyl)piperidine3carboxylicacid
1(carboxy(6(3carboxypropanamido)1Hindol3yl)methyl)piperidine3carboxylicacid
1(carboxy(6(3carboxypropanoylamino)1Hindol3yl)methyl)piperidine3carboxylicacid
1144471511
C1CC(CN(C1)C(C2=CNC3=C2C=CC(=C3)NC(=O)CCC(=O)O)C(=O)O)C(=O)O
InChI=1SC20H23N3O7c2416(5617(25)26)2212341314(92115(13)812)18(20(29)30)2371211(1023)19(27)28h3489111821H125710H2(H2224)(H2526)(H2728)(H2930)
MFCD12218358
OC(=O)CCC(=O)Nc1ccc2c(c1)(nH)cc2C(N1CCCC(C1)C(=O)O)C(=O)O
ZINC000031820937
ZINC000035585632

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Available files

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