Vitas-M small molecule compound
6-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,5-dimethyl-3-phenyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STL461170
SMILES O=C(N1CCC2(C(C1)CCCC2)O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C
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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 C30H31NO5 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO5/c1-18-22-14-24-26(35-19(2)28(24)20-8-4-3-5-9-20)16-25(22)36-29(33)23(18)15-27(32)31-13-12-30(34)11-7-6-10-21(30)17-31/h3-5,8-9,14,16,21,34H,6-7,10-13,15,17H2,1-2H3InChIKey
JOENYLCQGGWWGL-UHFFFAOYSA-NSynonyms
6(2(4ahydroxy13456788aoctahydroisoquinolin2yl)2oxoethyl)25dimethyl3phenylfuro(32g)chromen7one
6(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)25dimethyl3phenyl7Hfuro(32g)chromen7one
CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CC(=O)N5CCC6(CCCCC6C5)O
InChI=1SC30H31NO5c11822142426(3519(2)28(24)208435920)1625(22)3629(33)23(18)1527(32)31131230(34)11761021(30)1731h358914162134H6710131517H212H3
MFCD10040834
ZINC000002109798
ZINC000011867099
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