Vitas-M small molecule compound
(2E)-1-[1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STL235483
SMILES COc1cc(/C=C/C(=O)N2CCC3(C(C2c2ccc(cc2)F)CCCC3)O)cc(c1OC)OC
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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 C27H32FNO5 MW 469.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32FNO5/c1-32-22-16-18(17-23(33-2)26(22)34-3)7-12-24(30)29-15-14-27(31)13-5-4-6-21(27)25(29)19-8-10-20(28)11-9-19/h7-12,16-17,21,25,31H,4-6,13-15H2,1-3H3/b12-7+InChIKey
DNZACJPRGHVVTK-KPKJPENVSA-NSynonyms
1024744-94-2(2E)1(1(4fluorophenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)3(345trimethoxyphenyl)prop2en1one
(E)1(1(4fluorophenyl)4ahydroxy13456788aoctahydroisoquinolin2yl)3(345trimethoxyphenyl)prop2en1one
(E)1(1(4fluorophenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)3(345trimethoxyphenyl)prop2en1one
1024744942
COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCC3(CCCCC3C2C4=CC=C(C=C4)F)O
COc1cc(C=CC(=O)N2CCC3(C(C2c2ccc(cc2)F)CCCC3)O)cc(c1OC)OC
InChI=1SC27H32FNO5c132221618(1723(332)26(22)343)71224(30)29151427(31)1354621(27)25(29)1981020(28)11919h7121617212531H461315H213H3b127+
MFCD04173377
ZINC000002424778
ZINC000253389321
Check stock
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