Vitas-M small molecule compound
5-bromo-3-hydroxy-1-methyl-3-[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK216897
SMILES CN1C(=O)C(c2c1ccc(c2)Br)(O)CC(=O)C12CC3CC(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 C21H24BrNO3 MW 418.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24BrNO3/c1-23-17-3-2-15(22)7-16(17)21(26,19(23)25)11-18(24)20-8-12-4-13(9-20)6-14(5-12)10-20/h2-3,7,12-14,26H,4-6,8-11H2,1H3InChIKey
BFQXOPWEFAFFTM-UHFFFAOYSA-NSynonyms
3(2(1ADAMANTYL)2OXOETHYL)5BROMO3HYDROXY1METHYL13DIHYDRO2HINDOL2ONE
3(2(1ADAMANTYL)2OXOETHYL)5BROMO3HYDROXY1METHYLINDOL2ONE
3(2ADAMANTANYL2OXOETHYL)5BROMO3HYDROXY1METHYLINDOLIN2ONE
5bromo3hydroxy1methyl3(2oxo2(tricyclo(3311~37~)dec1yl)ethyl)13dihydro2Hindol2one
CN1C2=C(C=C(C=C2)Br)C(C1=O)(CC(=O)C34CC5CC(C3)CC(C5)C4)O
InChI=1SC21H24BrNO3c123173215(22)716(17)21(2619(23)25)1118(24)20812413(920)614(512)1020h237121426H46811H21H3
MFCD03837388
ZINC000004555012
ZINC000004555013
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