Vitas-M small molecule compound
3-hydroxy-1-(4-methylbenzyl)-3-[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK394813
SMILES Cc1ccc(cc1)CN1c2ccccc2C(C1=O)(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 C28H31NO3 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO3/c1-18-6-8-19(9-7-18)17-29-24-5-3-2-4-23(24)28(32,26(29)31)16-25(30)27-13-20-10-21(14-27)12-22(11-20)15-27/h2-9,20-22,32H,10-17H2,1H3InChIKey
GOKQFTCWWZYZHN-UHFFFAOYSA-NSynonyms
3(2(1ADAMANTYL)2OXOETHYL)3HYDROXY1((4METHYLPHENYL)METHYL)INDOL2ONE
3(2ADAMANTANYL2OXOETHYL)3HYDROXY1((4METHYLPHENYL)METHYL)INDOLIN2ONE
3hydroxy1(4methylbenzyl)3(2oxo2(tricyclo(3311~37~)dec1yl)ethyl)13dihydro2Hindol2one
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C45CC6CC(C4)CC(C6)C5)O
InChI=1SC28H31NO3c1186819(9718)172924532423(24)28(3226(29)31)1625(30)2713201021(1427)1222(1120)1527h29202232H1017H21H3
MFCD04042231
ZINC000004556177
ZINC000004556178
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