Vitas-M small molecule compound
N~2~-{(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}-N-1,3-benzodioxol-5-ylglycinamide
Catalog ID
STL547649
SMILES O=C(Nc1ccc2c(c1)OCO2)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 C27H24N2O9 MW 520.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O9/c1-11-23(33)21(13(3)30)25-22(24(11)34)27(4)18(38-25)8-15(31)20(26(27)35)12(2)28-9-19(32)29-14-5-6-16-17(7-14)37-10-36-16/h5-8,28,33-34H,9-10H2,1-4H3,(H,29,32)/b20-12+/t27-/m0/s1InChIKey
ZULCXLUMJJURPT-LKCKWYFFSA-NSynonyms
(RE)2((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)N(benzo(d)(13)dioxol5yl)acetamide
110207931
2(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)~(N)(13benzodioxol5yl)acetamide
InChI=1SC27H24N2O9c11123(33)21(13(3)30)2522(24(11)34)27(4)18(3825)815(31)20(26(27)35)12(2)28919(32)2914561617(714)37103616h58283334H910H214H3(H2932)b2012+t27m0s1
N~2~((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)N13benzodioxol5ylglycinamide
N2((1E)1((9BR)6ACETYL79DIHYDROXY89BDIMETHYL13DIOXO39BDIHYDRODIBENZO(BD)FURAN2(1H)YLIDENE)ETHYL)N13BENZODIOXOL5YLGLYCINAMIDE
O=C(Nc1ccc2c(c1)OCO2)CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000253415148
ZINC253415148
Check stock
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