Vitas-M small molecule compound
[4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-2(1H)-yl](phenyl)methanone
Catalog ID
STL178865
SMILES COc1cc(ccc1O)C1N(CCC2(C1CCCC2)O)C(=O)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 C23H27NO4 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4/c1-28-20-15-17(10-11-19(20)25)21-18-9-5-6-12-23(18,27)13-14-24(21)22(26)16-7-3-2-4-8-16/h2-4,7-8,10-11,15,18,21,25,27H,5-6,9,12-14H2,1H3InChIKey
PYOYKWGLTCKUAR-UHFFFAOYSA-NSynonyms
((1S4AR8AS)4AHYDROXY1(4HYDROXY3METHOXYPHENYL)OCTAHYDROISOQUINOLIN2(1H)YL)(PHENYL)METHANONE
(4ahydroxy1(4hydroxy3methoxyphenyl)13456788aoctahydroisoquinolin2yl)phenylmethanone
(4ahydroxy1(4hydroxy3methoxyphenyl)octahydroisoquinolin2(1H)yl)(phenyl)methanone
COC1=C(C=CC(=C1)C2C3CCCCC3(CCN2C(=O)C4=CC=CC=C4)O)O
InChI=1SC23H27NO4c128201517(101119(20)25)21189561223(1827)131424(21)22(26)167324816h247810111518212527H5691214H21H3
MFCD04143201
ZINC000002098753
ZINC000103158315
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