Vitas-M small molecule compound
3-hydroxy-3-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1-[(2E)-3-phenylprop-2-en-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK734835
SMILES O=C1N(C/C=C/c2ccccc2)c2c(C1(O)CC(=O)c1ccc3c(c1)CCCC3)cccc2
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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 C29H27NO3 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO3/c31-27(24-17-16-22-12-4-5-13-23(22)19-24)20-29(33)25-14-6-7-15-26(25)30(28(29)32)18-8-11-21-9-2-1-3-10-21/h1-3,6-11,14-17,19,33H,4-5,12-13,18,20H2/b11-8+InChIKey
SHDQAMIFOJALCO-DHZHZOJOSA-NSynonyms
3hydroxy3(2oxo2(5678tetrahydronaphthalen2yl)ethyl)1((2E)3phenylprop2en1yl)13dihydro2Hindol2one
3hydroxy3(2oxo2(5678tetrahydronaphthalen2yl)ethyl)1((E)3phenylprop2enyl)indol2one
C1CCC2=C(C1)C=CC(=C2)C(=O)CC3(C4=CC=CC=C4N(C3=O)CC=CC5=CC=CC=C5)O
InChI=1SC29H27NO3c3127(2417162212451323(22)1924)2029(33)2514671526(25)30(28(29)32)188112192131021h1361114171933H4512131820H2b118+
MFCD03768483
O=C1N(CC=Cc2ccccc2)c2c(C1(O)CC(=O)c1ccc3c(c1)CCCC3)cccc2
ZINC000001076372
ZINC000001076374
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