Vitas-M small molecule compound

(2E)-1-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-3-[4-(propan-2-yl)phenyl]prop-2-en-1-one

Catalog ID
STL512296
SMILES COc1ccccc1C1N(CCC2(C1CCCC2)O)C(=O)/C=C/c1ccc(cc1)C(C)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C28H35NO3 MW 433.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35NO3/c1-20(2)22-14-11-21(12-15-22)13-16-26(30)29-19-18-28(31)17-7-6-9-24(28)27(29)23-8-4-5-10-25(23)32-3/h4-5,8,10-16,20,24,27,31H,6-7,9,17-19H2,1-3H3/b16-13+
InChIKey
FPVFEIBTNZKHAV-DTQAZKPQSA-N
Synonyms

(~(E))1(4~(a)hydroxy1(2methoxyphenyl)13456788~(a)octahydroisoquinolin2yl)3(4propan2ylphenyl)prop2en1one
(2E)1(4ahydroxy1(2methoxyphenyl)octahydroisoquinolin2(1H)yl)3(4(propan2yl)phenyl)prop2en1one
(E)1((1R)4ahydroxy1(2methoxyphenyl)octahydroisoquinolin2(1H)yl)3(4isopropylphenyl)prop2en1one
5937747
COc1ccccc1(C@@H)1N(CCC2(C1CCCC2)O)C(=O)C=Cc1ccc(cc1)C(C)C
InChI=1SC28H35NO3c120(2)22141121(121522)131626(30)29191828(31)1776924(28)27(29)238451025(23)323h458101620242731H6791719H213H3b1613+
MFCD04145590
ZINC000002103719
ZINC000250567162

Check stock

See real-time availability and sample size for STL512296 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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