Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-2-[1-({2-hydroxy-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenyl}amino)ethylidene]-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL551586
SMILES CC(n1nnc(n1)c1ccc(c(c1)N/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)O)C
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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 C28H27N5O7 MW 545.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O7/c1-11(2)33-31-27(30-32-33)15-7-8-17(35)16(9-15)29-13(4)20-18(36)10-19-28(6,26(20)39)22-24(38)12(3)23(37)21(14(5)34)25(22)40-19/h7-11,29,35,37-38H,1-6H3/b20-13+/t28-/m0/s1InChIKey
JDDMLDADIRUZLQ-JVELKTRGSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1(2hydroxy5(2propan2yltetrazol5yl)anilino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1((2hydroxy5(2(propan2yl)2Htetrazol5yl)phenyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl79dihydroxy2(1((2hydroxy5(2isopropyl2Htetrazol5yl)phenyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
135639974
CC(n1nnc(n1)c1ccc(c(c1)NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C)O)C
InChI=1SC28H27N5O7c111(2)333127(303233)157817(35)16(915)2913(4)2018(36)101928(626(20)39)2224(38)12(3)23(37)21(14(5)34)25(22)4019h71129353738H16H3b2013+t28m0s1
ZINC000822288999
Check stock
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Check stock on Vitas-MAvailable files
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