Vitas-M small molecule compound
N-[4-({(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)phenyl]-2-methylpropanamide
Catalog ID
STL550775
SMILES CC(C(=O)Nc1ccc(cc1)N/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)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 C28H28N2O7 MW 504.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O7/c1-12(2)27(36)30-17-9-7-16(8-10-17)29-14(4)20-18(32)11-19-28(6,26(20)35)22-24(34)13(3)23(33)21(15(5)31)25(22)37-19/h7-12,29,33-34H,1-6H3,(H,30,36)/b20-14+/t28-/m0/s1InChIKey
BEPIGHAQOUVIKV-FKCOHSBYSA-NSynonyms
(RE)N(4((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)phenyl)isobutyramide
~(N)(4(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)phenyl)2methylpropanamide
132351975
CC(C(=O)Nc1ccc(cc1)NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C)C
InChI=1SC28H28N2O7c112(2)27(36)30179716(81017)2914(4)2018(32)111928(626(20)35)2224(34)13(3)23(33)21(15(5)31)25(22)3719h712293334H16H3(H3036)b2014+t28m0s1
N(4(((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)amino)phenyl)2methylpropanamide
ZINC000820638462
Check stock
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Check stock on Vitas-MAvailable files
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