Vitas-M small molecule compound
9-{[1-(4a-hydroxy-1-phenyloctahydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]oxy}-7-methyl-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Catalog ID
STL565509
SMILES Cc1cc(OC(C(=O)N2CCC3(C(C2c2ccccc2)CCCC3)O)C)c2c(c1)oc(=O)c1c2CCC1
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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 C31H35NO5 MW 501.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO5/c1-19-17-25(27-22-11-8-12-23(22)30(34)37-26(27)18-19)36-20(2)29(33)32-16-15-31(35)14-7-6-13-24(31)28(32)21-9-4-3-5-10-21/h3-5,9-10,17-18,20,24,28,35H,6-8,11-16H2,1-2H3InChIKey
BWQNNIAILQPYSH-UHFFFAOYSA-NSynonyms
1005271-90-81005271908
4836599
9((1((1R)4ahydroxy1phenyloctahydroisoquinolin2(1H)yl)1oxopropan2yl)oxy)7methyl23dihydrocyclopenta(c)chromen4(1H)one
9((1(4ahydroxy1phenyloctahydroisoquinolin2(1H)yl)1oxopropan2yl)oxy)7methyl23dihydrocyclopenta(c)chromen4(1H)one
9(1(4ahydroxy1phenyl13456788aoctahydroisoquinolin2yl)1oxopropan2yl)oxy7methyl23dihydro1Hcyclopenta(c)chromen4one
Cc1cc(OC(C(=O)N2CCC3(C((C@@H)2c2ccccc2)CCCC3)O)C)c2c(c1)oc(=O)c1c2CCC1
InChI=1SC31H35NO5c1191725(27221181223(22)30(34)3726(27)1819)3620(2)29(33)32161531(35)14761324(31)28(32)2194351021h35910171820242835H681116H212H3
MFCD06495452
ZINC000002136469
ZINC000252693309
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