Vitas-M small molecule compound
methyl 5-hydroxy-2-methyl-1-[3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propyl]-1H-benzo[g]indole-3-carboxylate
Catalog ID
STK785059
SMILES COC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)CCCOC12CC3CC(C2)CC(C1)C3
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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 C28H33NO4 MW 447.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO4/c1-17-25(27(31)32-2)23-13-24(30)21-6-3-4-7-22(21)26(23)29(17)8-5-9-33-28-14-18-10-19(15-28)12-20(11-18)16-28/h3-4,6-7,13,18-20,30H,5,8-12,14-16H2,1-2H3InChIKey
WZCPOQLNBMYCDI-UHFFFAOYSA-NSynonyms
CC1=C(C2=C(N1CCCOC34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6C(=C2)O)C(=O)OC
InChI=1SC28H33NO4c11725(27(31)322)231324(30)21634722(21)26(23)29(17)859332814181019(1528)1220(1118)1628h346713182030H58121416H212H3
METHYL1(3(1ADAMANTYLOXY)PROPYL)5HYDROXY2METHYLBENZO(G)INDOLE3CARBOXYLATE
methyl5hydroxy2methyl1(3(tricyclo(3311~37~)dec1yloxy)propyl)1Hbenzo(g)indole3carboxylate
MFCD07657683
ZINC000012372301
ZINC12372301
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