Vitas-M small molecule compound
[4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-2(1H)-yl](2-methoxyphenyl)methanone
Catalog ID
STL178868
SMILES COc1cc(ccc1O)C1N(CCC2(C1CCCC2)O)C(=O)c1ccccc1OC
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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 C24H29NO5 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO5/c1-29-20-9-4-3-7-17(20)23(27)25-14-13-24(28)12-6-5-8-18(24)22(25)16-10-11-19(26)21(15-16)30-2/h3-4,7,9-11,15,18,22,26,28H,5-6,8,12-14H2,1-2H3InChIKey
XQUREHCNYSPPLI-UHFFFAOYSA-NSynonyms
((1S4AR8AR)4AHYDROXY1(4HYDROXY3METHOXYPHENYL)OCTAHYDROISOQUINOLIN2(1H)YL)(2METHOXYPHENYL)METHANONE
(4ahydroxy1(4hydroxy3methoxyphenyl)13456788aoctahydroisoquinolin2yl)(2methoxyphenyl)methanone
(4ahydroxy1(4hydroxy3methoxyphenyl)octahydroisoquinolin2(1H)yl)(2methoxyphenyl)methanone
COC1=CC=CC=C1C(=O)N2CCC3(CCCCC3C2C4=CC(=C(C=C4)O)OC)O
InChI=1SC24H29NO5c12920943717(20)23(27)25141324(28)1265818(24)22(25)16101119(26)21(1516)302h3479111518222628H5681214H212H3
MFCD04146075
ZINC000002104983
ZINC000245253991
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