Vitas-M small molecule compound
(2E)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diphenylmethyl)-3-hydroxybut-2-en-1-one
Catalog ID
STK592123
SMILES COc1cc2CN(CCc2cc1OC)C(=O)/C(=C(/O)\C)/C(c1ccccc1)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 C28H29NO4 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO4/c1-19(30)26(27(20-10-6-4-7-11-20)21-12-8-5-9-13-21)28(31)29-15-14-22-16-24(32-2)25(33-3)17-23(22)18-29/h4-13,16-17,27,30H,14-15,18H2,1-3H3/b26-19+InChIKey
HJWLDOSTUUQPHF-LGUFXXKBSA-NSynonyms
883952-82-7(2E)1(67dimethoxy34dihydroisoquinolin2(1H)yl)2(diphenylmethyl)3hydroxybut2en1one
(E)2benzhydryl1(67dimethoxy34dihydro1Hisoquinolin2yl)3hydroxybut2en1one
(E)2benzhydryl1(67dimethoxy34dihydroisoquinolin2(1H)yl)3hydroxybut2en1one
(E)3BENZHYDRYL4(67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)4HYDROXYBUT3EN2ONE
3BENZHYDRYL4(67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)4HYDROXYBUT3EN2ONE
883952827
CC(=C(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)O
COc1cc2CN(CCc2cc1OC)C(=O)C(=C(O)C)C(c1ccccc1)c1ccccc1
InChI=1SC28H29NO4c119(30)26(27(20106471120)21128591321)28(31)291514221624(322)25(333)1723(22)1829h41316172730H141518H213H3b2619+
MFCD06770868
ZINC000100887536
ZINC100887536
Check stock
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Check stock on Vitas-MAvailable files
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