Vitas-M small molecule compound
(E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Catalog ID
STL040071
SMILES COc1cc(cc(c1OC)OC)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC)/[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 C27H29N3O7 MW 507.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O7/c1-34-19-8-6-17(7-9-19)24(31)22-23(18-14-20(35-2)26(37-4)21(15-18)36-3)30(27(33)25(22)32)12-5-11-29-13-10-28-16-29/h6-10,13-16,23,31H,5,11-12H2,1-4H3/b24-22+InChIKey
HVYORBNAZDAOCJ-ZNTNEXAZSA-NSynonyms
371141-94-5(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(1Himidazol3ium1yl)propyl)45dioxo2(345trimethoxyphenyl)pyrrolidin3ylidene)(4methoxyphenyl)methanolate
371141945
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC(=C(C(=C4)OC)OC)OC)O
COc1cc(cc(c1OC)OC)C1N(CCCn2c(nH+)cc2)C(=O)C(=O)C1=C(c1ccc(cc1)OC)(O)
InChI=1SC27H29N3O7c134198617(7919)24(31)2223(181420(352)26(374)21(1518)363)30(27(33)25(22)32)12511291310281629h61013162331H51112H214H3b2422+
MFCD18247950
ZINC000102864462
ZINC000102864464
Check stock
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