Vitas-M small molecule compound
methyl 3-(7-chloro-4'-hydroxy-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-3'-yl)-3-[3-(pyridin-3-ylmethoxy)phenyl]propanoate
Catalog ID
STL549710
SMILES COC(=O)CC(C1=C(O)CC(C2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)c1cccc(c1)OCc1cccnc1
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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 C32H30ClNO9 MW 608.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClNO9/c1-17-11-22(35)26(30(37)32(17)31(38)27-23(39-2)14-24(40-3)28(33)29(27)43-32)21(13-25(36)41-4)19-8-5-9-20(12-19)42-16-18-7-6-10-34-15-18/h5-10,12,14-15,17,21,35H,11,13,16H2,1-4H3InChIKey
AYWOZHPXQWKABF-UHFFFAOYSA-NSynonyms
InChI=1SC32H30ClNO9c1171122(35)26(30(37)32(17)31(38)2723(392)1424(403)28(33)29(27)4332)21(1325(36)414)1985920(1219)4216187610341518h510121415172135H111316H214H3
methyl3(7chloro4hydroxy46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)3yl)3(3(pyridin3ylmethoxy)phenyl)propanoate
MFCD31757156
ZINC000888089719
ZINC000888089722
Check stock
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Check stock on Vitas-MAvailable files
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