Vitas-M small molecule compound
7-{[1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]oxy}-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL461114
SMILES O=C(C(Oc1ccc2c(c1C)oc(=O)cc2C)C)N1CCC2(C(C1)CCCC2)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 C23H29NO5 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5/c1-14-12-20(25)29-21-15(2)19(8-7-18(14)21)28-16(3)22(26)24-11-10-23(27)9-5-4-6-17(23)13-24/h7-8,12,16-17,27H,4-6,9-11,13H2,1-3H3InChIKey
QLSQIRLUTZBLDK-UHFFFAOYSA-NSynonyms
7((1(4ahydroxyoctahydroisoquinolin2(1H)yl)1oxopropan2yl)oxy)48dimethyl2Hchromen2one
7(1(4ahydroxy13456788aoctahydroisoquinolin2yl)1oxopropan2yl)oxy48dimethylchromen2one
CC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)N3CCC4(CCCCC4C3)O
InChI=1SC23H29NO5c1141220(25)292115(2)19(8718(14)21)2816(3)22(26)24111023(27)954617(23)1324h7812161727H4691113H213H3
MFCD10040779
ZINC000002109608
ZINC000082059793
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