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-methyl-L-alaninamide
Catalog ID
STL547286
SMILES CNC(=O)[C@@H](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 C22H24N2O7 MW 428.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O7/c1-8-17(27)15(11(4)25)19-16(18(8)28)22(5)13(31-19)7-12(26)14(20(22)29)9(2)24-10(3)21(30)23-6/h7,10,24,27-28H,1-6H3,(H,23,30)/b14-9+/t10-,22-/m0/s1InChIKey
GWKLBGJICWVQTP-AYGICIEISA-NSynonyms
(2~(S))2(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)~(N)methylpropanamide
(S)2(((E)1((R)6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)Nmethylpropanamide
121541316
CNC(=O)(C@@H)(NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C)C
InChI=1SC22H24N2O7c1817(27)15(11(4)25)1916(18(8)28)22(5)13(3119)712(26)14(20(22)29)9(2)2410(3)21(30)236h710242728H16H3(H2330)b149+t1022m0s1
N~2~((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)NmethylLalaninamide
N2((1E)1((9BR)6ACETYL79DIHYDROXY89BDIMETHYL13DIOXO39BDIHYDRODIBENZO(BD)FURAN2(1H)YLIDENE)ETHYL)NMETHYLLALANINAMIDE
ZINC000263585264
ZINC263585264
Check stock
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