Vitas-M small molecule compound
6-[(3-{[(2S)-2-carbamoylpyrrolidin-1-yl](carboxy)methyl}-1H-indol-6-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK660128
SMILES O=C(C1CC=CCC1C(=O)O)Nc1ccc2c(c1)[nH]cc2C(N1CCC[C@H]1C(=O)N)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 C23H26N4O6 MW 454.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O6/c24-20(28)18-6-3-9-27(18)19(23(32)33)16-11-25-17-10-12(7-8-13(16)17)26-21(29)14-4-1-2-5-15(14)22(30)31/h1-2,7-8,10-11,14-15,18-19,25H,3-6,9H2,(H2,24,28)(H,26,29)(H,30,31)(H,32,33)/t14?,15?,18-,19?/m0/s1InChIKey
BWAZIXXSFLWCIY-XHVMPKOQSA-NSynonyms
1219125-72-01219125720
6((3(((2S)2carbamoylpyrrolidin1yl)(carboxy)methyl)1Hindol6yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3(((2S)2carbamoylpyrrolidin1yl)carboxymethyl)1Hindol6yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3(((S)2carbamoylpyrrolidin1yl)(carboxy)methyl)1Hindol6yl)carbamoyl)cyclohex3enecarboxylicacid
C1CC(N(C1)C(C2=CNC3=C2C=CC(=C3)NC(=O)C4CC=CCC4C(=O)O)C(=O)O)C(=O)N
InChI=1SC23H26N4O6c2420(28)1863927(18)19(23(32)33)161125171012(7813(16)17)2621(29)14412515(14)22(30)31h127810111415181925H369H2(H22428)(H2629)(H3031)(H3233)t14?15?1819?m0s1
MFCD18168959
O=C(C1CC=CCC1C(=O)O)Nc1ccc2c(c1)(nH)cc2C(N1CCC(C@H)1C(=O)N)C(=O)O
ZINC000036353953
ZINC000036353958
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.