Vitas-M small molecule compound
3-benzyl-7-{2-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-2-oxoethoxy}-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL537850
SMILES O=C(N1CC[C@@]2([C@H](C1)CCCC2)O)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
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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 C29H33NO5 MW 475.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO5/c1-19-23-11-12-25(20(2)27(23)35-28(32)24(19)16-21-8-4-3-5-9-21)34-18-26(31)30-15-14-29(33)13-7-6-10-22(29)17-30/h3-5,8-9,11-12,22,33H,6-7,10,13-18H2,1-2H3/t22-,29-/m0/s1InChIKey
LIXQPAOCXJANOU-ZTOMLWHTSA-NSynonyms
1212327-22-43benzyl7(2((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)48dimethyl2Hchromen2one
3benzyl7(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)48dimethyl2Hchromen2one
7(2((4~(a)~(S)8~(a)~(S))4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethoxy)3benzyl48dimethylchromen2one
O=C(N1CCC2(C(C1)CCCC2)O)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
Registry IDs
MFCD05671548ZINC000008918263
ZINC8918263
Check stock
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Check stock on Vitas-MAvailable files
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