Vitas-M small molecule compound
6-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK665087
SMILES O=C(C1CC=CCC1C(=O)O)Nc1ccc2c(c1)c1CCCCc1o2
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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 C20H21NO4 MW 339.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4/c22-19(14-6-1-2-7-15(14)20(23)24)21-12-9-10-18-16(11-12)13-5-3-4-8-17(13)25-18/h1-2,9-11,14-15H,3-8H2,(H,21,22)(H,23,24)InChIKey
VLLLKBSANCJDDA-UHFFFAOYSA-NSynonyms
6(6789tetrahydrodibenzo(bd)furan2ylcarbamoyl)cyclohex3ene1carboxylicacid
6(6789tetrahydrodibenzofuran2ylcarbamoyl)cyclohex3ene1carboxylicacid
C1CCC2=C(C1)C3=C(O2)C=CC(=C3)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC20H21NO4c2219(14612715(14)20(23)24)21129101816(1112)13534817(13)2518h129111415H38H2(H2122)(H2324)
MFCD07800469
ZINC000004788688
ZINC000004788700
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