Vitas-M small molecule compound
3-[2-(4-cyclohexylphenyl)-2-oxoethyl]-3-hydroxy-1-[(2E)-3-phenylprop-2-en-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK734821
SMILES O=C(c1ccc(cc1)C1CCCCC1)CC1(O)C(=O)N(c2c1cccc2)C/C=C/c1ccccc1
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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 C31H31NO3 MW 465.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO3/c33-29(26-19-17-25(18-20-26)24-13-5-2-6-14-24)22-31(35)27-15-7-8-16-28(27)32(30(31)34)21-9-12-23-10-3-1-4-11-23/h1,3-4,7-12,15-20,24,35H,2,5-6,13-14,21-22H2/b12-9+InChIKey
PHEKTIMZYIKZCR-FMIVXFBMSA-NSynonyms
3(2(4cyclohexylphenyl)2oxoethyl)3hydroxy1((2E)3phenylprop2en1yl)13dihydro2Hindol2one
3(2(4CYCLOHEXYLPHENYL)2OXOETHYL)3HYDROXY1((E)3PHENYLPROP2ENYL)INDOL2ONE
C1CCC(CC1)C2=CC=C(C=C2)C(=O)CC3(C4=CC=CC=C4N(C3=O)CC=CC5=CC=CC=C5)O
InChI=1SC31H31NO3c3329(26191725(182026)24135261424)2231(35)2715781628(27)32(30(31)34)2191223103141123h13471215202435H25613142122H2b129+
MFCD03768484
O=C(c1ccc(cc1)C1CCCCC1)CC1(O)C(=O)N(c2c1cccc2)CC=Cc1ccccc1
ZINC000009972536
ZINC000009972537
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