Vitas-M small molecule compound
methyl 3-[6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]-3-(3,4,5-trimethoxyphenyl)propanoate
Catalog ID
STL550613
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cccc3)cc(=O)c1O)c1cc(OC)c(c(c1)OC)OC
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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 C28H31NO8 MW 509.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO8/c1-33-23-11-19(12-24(34-2)28(23)36-4)21(14-25(31)35-3)27-26(32)22(30)13-20(37-27)16-29-10-9-17-7-5-6-8-18(17)15-29/h5-8,11-13,21,32H,9-10,14-16H2,1-4H3InChIKey
VNPAQXHSERANBQ-UHFFFAOYSA-NSynonyms
129895507
InChI=1SC28H31NO8c133231119(1224(342)28(23)364)21(1425(31)353)2726(32)22(30)1320(3727)162910917756818(17)1529h5811132132H9101416H214H3
methyl3(6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(345trimethoxyphenyl)propanoate
methyl3(6(34dihydro1~(H)isoquinolin2ylmethyl)3hydroxy4oxopyran2yl)3(345trimethoxyphenyl)propanoate
methyl3(6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy4oxo4Hpyran2yl)3(345trimethoxyphenyl)propanoate
MFCD31757681
ZINC000524731384
ZINC000524731385
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