Vitas-M small molecule compound
3-[({(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)methyl]benzoic acid
Catalog ID
STL547359
SMILES OC(=O)c1cccc(c1)CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)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 C26H23NO8 MW 477.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO8/c1-11-21(30)19(13(3)28)23-20(22(11)31)26(4)17(35-23)9-16(29)18(24(26)32)12(2)27-10-14-6-5-7-15(8-14)25(33)34/h5-9,27,30-31H,10H2,1-4H3,(H,33,34)/b18-12+/t26-/m0/s1InChIKey
IEVAIABZJPICBW-ICCXZJDVSA-NSynonyms
(RE)3(((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)methyl)benzoicacid
110206219
3((((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)methyl)benzoicacid
3((((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)amino)methyl)benzoicacid
InChI=1SC26H23NO8c11121(30)19(13(3)28)2320(22(11)31)26(4)17(3523)916(29)18(24(26)32)12(2)27101465715(814)25(33)34h59273031H10H214H3(H3334)b1812+t26m0s1
OC(=O)c1cccc(c1)CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000253405279
ZINC253405279
Check stock
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