Vitas-M small molecule compound
7-hydroxy-4-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-8-methyl-2H-chromen-2-one
Catalog ID
STL548655
SMILES O=C(N1CCC2(C(C1)CCCC2)O)Cc1cc(=O)oc2c1ccc(c2C)O
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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 C21H25NO5 MW 371.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO5/c1-13-17(23)6-5-16-14(11-19(25)27-20(13)16)10-18(24)22-9-8-21(26)7-3-2-4-15(21)12-22/h5-6,11,15,23,26H,2-4,7-10,12H2,1H3InChIKey
YPJHBHYMJRSWQM-UHFFFAOYSA-NSynonyms
4(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethyl)7hydroxy8methylchromen2one
5934518
7hydroxy4(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)8methyl2Hchromen2one
InChI=1SC21H25NO5c11317(23)651614(1119(25)2720(13)16)1018(24)229821(26)732415(21)1222h5611152326H2471012H21H3
MFCD31756792
ZINC000002111498
ZINC000015954922
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