Vitas-M small molecule compound

ethyl 5-hydroxy-2-methyl-1-{2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl}-1H-benzo[g]indole-3-carboxylate

Catalog ID
STK765097
SMILES CCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)CCOc1ccc(cc1)C(c1ccccc1)(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 C33H33NO4 MW 507.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO4/c1-5-37-32(36)30-22(2)34(31-27-14-10-9-13-26(27)29(35)21-28(30)31)19-20-38-25-17-15-24(16-18-25)33(3,4)23-11-7-6-8-12-23/h6-18,21,35H,5,19-20H2,1-4H3
InChIKey
GRELJJHCZLQVQQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CCOC4=CC=C(C=C4)C(C)(C)C5=CC=CC=C5)C
ETHYL5HYDROXY2METHYL1(2(4(1METHYL1PHENYLETHYL)PHENOXY)ETHYL)1HBENZO(G)INDOLE3CARBOXYLATE
ETHYL5HYDROXY2METHYL1(2(4(1METHYL1PHENYLETHYL)PHENOXY)ETHYL)BENZO(G)INDOLE3CARBOXYLATE
ethyl5hydroxy2methyl1(2(4(2phenylpropan2yl)phenoxy)ethyl)1Hbenzo(g)indole3carboxylate
ETHYL5HYDROXY2METHYL1(2(4(2PHENYLPROPAN2YL)PHENOXY)ETHYL)BENZO(G)INDOLE3CARBOXYLATE
InChI=1SC33H33NO4c153732(36)3022(2)34(3127141091326(27)29(35)2128(30)31)19203825171524(161825)33(34)23117681223h6182135H51920H214H3
MFCD02852875
ZINC000002190600
ZINC02190600
ZINC2190600

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.