Vitas-M small molecule compound
(2Z)-6-{2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethoxy}-2-(2,4,5-trimethoxybenzylidene)-1-benzofuran-3(2H)-one
Catalog ID
STL535235
SMILES OC[C@@H]1CCCN1C(=O)COc1ccc2c(c1)O/C(=C\c1cc(OC)c(cc1OC)OC)/C2=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 C25H27NO8 MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO8/c1-30-19-12-22(32-3)21(31-2)9-15(19)10-23-25(29)18-7-6-17(11-20(18)34-23)33-14-24(28)26-8-4-5-16(26)13-27/h6-7,9-12,16,27H,4-5,8,13-14H2,1-3H3/b23-10-/t16-/m0/s1InChIKey
JXLMHDDUTZTWCK-CUOULEQJSA-NSynonyms
1014041-04-3(2~(Z))6(2((2~(S))2(hydroxymethyl)pyrrolidin1yl)2oxoethoxy)2((245trimethoxyphenyl)methylidene)1benzofuran3one
(2Z)6(2((2S)2(hydroxymethyl)pyrrolidin1yl)2oxoethoxy)2(245trimethoxybenzylidene)1benzofuran3(2H)one
(SZ)6(2(2(HYDROXYMETHYL)PYRROLIDIN1YL)2OXOETHOXY)2(245TRIMETHOXYBENZYLIDENE)BENZOFURAN3(2H)ONE
1014041043
17572302
InChI=1SC25H27NO8c130191222(323)21(312)915(19)102325(29)187617(1120(18)3423)331424(28)2684516(26)1327h679121627H4581314H213H3b2310t16m0s1
OC(C@@H)1CCCN1C(=O)COc1ccc2c(c1)OC(=Cc1cc(OC)c(cc1OC)OC)C2=O
ZINC000012902796
ZINC12902796
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