Vitas-M small molecule compound
3-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
Catalog ID
STK681265
SMILES CCCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(OCc2ccccc2)cc3)CC(CC1=O)(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 C31H38N2O3 MW 486.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N2O3/c1-5-6-12-28(34)30-27(18-31(3,4)19-29(30)35)32-16-15-24-21(2)33-26-14-13-23(17-25(24)26)36-20-22-10-8-7-9-11-22/h7-11,13-14,17,32-33H,5-6,12,15-16,18-20H2,1-4H3InChIKey
HUXLRKOFNGSTDO-UHFFFAOYSA-NSynonyms
3((2(5(benzyloxy)2methyl1Hindol3yl)ethyl)amino)55dimethyl2pentanoylcyclohex2en1one55DIMETHYL3(2(2METHYL5PHENYLMETHOXY1HINDOL3YL)ETHYLAMINO)2PENTANOYLCYCLOHEX2EN1ONE
CCCCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=C(NC3=C2C=C(C=C3)OCC4=CC=CC=C4)C
CCCCC(=O)C1=C(NCCc2c(C)(nH)c3c2cc(OCc2ccccc2)cc3)CC(CC1=O)(C)C
Registry IDs
MFCD03768775ZINC000100140349
ZINC100140349
Check stock
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Check stock on Vitas-MAvailable files
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