Vitas-M small molecule compound

methyl {8-[(cyclopentylamino)methyl]-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STK617008
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2CNC1CCCC1)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 C19H23NO5 MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO5/c1-11-13-7-8-16(21)15(10-20-12-5-3-4-6-12)18(13)25-19(23)14(11)9-17(22)24-2/h7-8,12,20-21H,3-6,9-10H2,1-2H3
InChIKey
IADDLINQSGNPBK-UHFFFAOYSA-N
Synonyms

CC1=C(C(=O)OC2=C1C=CC(=C2CNC3CCCC3)O)CC(=O)OC
COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2CNC1CCCC1)OCl
InChI=1SC19H23NO5c111137816(21)15(102012534612)18(13)2519(23)14(11)917(22)242h78122021H36910H212H3
methyl(8((cyclopentylamino)methyl)7hydroxy4methyl2oxo2Hchromen3yl)acetate
methyl2(8((cyclopentylamino)methyl)7hydroxy4methyl2oxo2Hchromen3yl)acetatehydrochloride
methyl2(8((cyclopentylamino)methyl)7hydroxy4methyl2oxochromen3yl)acetate
MFCD08748962
ZINC000013628490
ZINC13628490

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.