Vitas-M small molecule compound
[(3R,5S)-3,5-dimethylpiperidin-1-yl]{6-[(2-methylpropanoyl)amino]-1H-indol-3-yl}acetic acid
Catalog ID
STK657152
SMILES C[C@@H]1C[C@H](C)CN(C1)C(c1c[nH]c2c1ccc(c2)NC(=O)C(C)C)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 C21H29N3O3 MW 371.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O3/c1-12(2)20(25)23-15-5-6-16-17(9-22-18(16)8-15)19(21(26)27)24-10-13(3)7-14(4)11-24/h5-6,8-9,12-14,19,22H,7,10-11H2,1-4H3,(H,23,25)(H,26,27)/t13-,14+,19?InChIKey
JAGVASDJLDZGSM-FSWDVZBNSA-NSynonyms
1214116-84-3((3R5S)35dimethylpiperidin1yl)(6((2methylpropanoyl)amino)1Hindol3yl)aceticacid
1214116843
2((3R5S)35dimethylpiperidin1yl)2(6(2methylpropanoylamino)1Hindol3yl)aceticacid
2((3R5S)35dimethylpiperidin1yl)2(6isobutyramido1Hindol3yl)aceticacid
C(C@@H)1C(C@H)(C)CN(C1)C(c1c(nH)c2c1ccc(c2)NC(=O)C(C)C)C(=O)O
CC1CC(CN(C1)C(C2=CNC3=C2C=CC(=C3)NC(=O)C(C)C)C(=O)O)C
InChI=1SC21H29N3O3c112(2)20(25)2315561617(92218(16)815)19(21(26)27)241013(3)714(4)1124h568912141922H71011H214H3(H2325)(H2627)t1314+19?
MFCD13759892
ZINC000036360782
ZINC000036360783
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