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-(2,4,5-trimethoxyphenyl)propanoate
Catalog ID
STL551249
SMILES COC(=O)CC(C1=C(O)CC(C2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)c1cc(OC)c(cc1OC)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 C29H31ClO11 MW 591.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31ClO11/c1-13-8-16(31)23(15(10-22(32)40-7)14-9-18(36-3)19(37-4)11-17(14)35-2)27(33)29(13)28(34)24-20(38-5)12-21(39-6)25(30)26(24)41-29/h9,11-13,15,31H,8,10H2,1-7H3InChIKey
WWBSDFGSUZJHED-UHFFFAOYSA-NSynonyms
InChI=1SC29H31ClO11c113816(31)23(15(1022(32)407)14918(363)19(374)1117(14)352)27(33)29(13)28(34)2420(385)1221(396)25(30)26(24)4129h911131531H810H217H3
methyl3(7chloro4hydroxy46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)3yl)3(245trimethoxyphenyl)propanoate
MFCD31758028
ZINC000888090826
ZINC000888090829
Check stock
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Check stock on Vitas-MAvailable files
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