Vitas-M small molecule compound
7-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methyl-4-phenyl-2H-chromen-2-one
Catalog ID
STL546658
SMILES O=C(N1CCC2(C(C1)CCCC2)O)COc1ccc2c(c1C)oc(=O)cc2c1ccccc1
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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 C27H29NO5 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO5/c1-18-23(32-17-24(29)28-14-13-27(31)12-6-5-9-20(27)16-28)11-10-21-22(15-25(30)33-26(18)21)19-7-3-2-4-8-19/h2-4,7-8,10-11,15,20,31H,5-6,9,12-14,16-17H2,1H3InChIKey
HIWDCYQWMCCQQA-UHFFFAOYSA-NSynonyms
3709115
7(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethoxy)8methyl4phenylchromen2one
7(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)8methyl4phenyl2Hchromen2one
InChI=1SC27H29NO5c11823(321724(29)28141327(31)1265920(27)1628)11102122(1525(30)3326(18)21)197324819h24781011152031H56912141617H21H3
MFCD31756437
ZINC000002111550
ZINC000015954929
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