Vitas-M small molecule compound
trans-4-[({2-[(6-chloro-3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}amino)methyl]cyclohexanecarboxylic acid
Catalog ID
STL530621
SMILES CC(C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)Oc1cc2oc(=O)c(c(c2cc1Cl)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 C22H26ClNO6 MW 435.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClNO6/c1-11-12(2)22(28)30-18-9-19(17(23)8-16(11)18)29-13(3)20(25)24-10-14-4-6-15(7-5-14)21(26)27/h8-9,13-15H,4-7,10H2,1-3H3,(H,24,25)(H,26,27)/t13?,14-,15-InChIKey
OUONAQFJFXQPST-NJIVVBIYSA-NSynonyms
(1r4r)4((2((6chloro34dimethyl2oxo2Hchromen7yl)oxy)propanamido)methyl)cyclohexanecarboxylicacid
CC(C(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)C
InChI=1SC22H26ClNO6c11112(2)22(28)3018919(17(23)816(11)18)2913(3)20(25)2410144615(7514)21(26)27h891315H4710H213H3(H2425)(H2627)t13?1415
MFCD05675218
trans4(((2((6chloro34dimethyl2oxo2Hchromen7yl)oxy)propanoyl)amino)methyl)cyclohexanecarboxylicacid
ZINC000252694716
ZINC000252694717
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