Vitas-M small molecule compound
5-({(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}amino)-2-hydroxy-3-methylbenzoic acid
Catalog ID
STL551281
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/Nc1cc(C)c(c(c1)C(=O)O)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 C26H23NO9 MW 493.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO9/c1-9-6-13(7-14(20(9)30)25(34)35)27-11(3)17-15(29)8-16-26(5,24(17)33)19-22(32)10(2)21(31)18(12(4)28)23(19)36-16/h6-8,27,30-32H,1-5H3,(H,34,35)/b17-11+/t26-/m0/s1InChIKey
WGMAGQZTZPMZTI-LJZAYONRSA-NSynonyms
(RE)5((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)2hydroxy3methylbenzoicacid
132352224
5(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)2hydroxy3methylbenzoicacid
5(((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)amino)2hydroxy3methylbenzoicacid
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)Nc1cc(C)c(c(c1)C(=O)O)O
InChI=1SC26H23NO9c19613(714(20(9)30)25(34)35)2711(3)1715(29)81626(524(17)33)1922(32)10(2)21(31)18(12(4)28)23(19)3616h68273032H15H3(H3435)b1711+t26m0s1
ZINC000820386091
Check stock
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Check stock on Vitas-MAvailable files
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