Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-2-{1-[(3-methoxypropyl)amino]ethylidene}-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL547743
SMILES COCCCN/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 C22H25NO7 MW 415.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO7/c1-10-18(26)16(12(3)24)20-17(19(10)27)22(4)14(30-20)9-13(25)15(21(22)28)11(2)23-7-6-8-29-5/h9,23,26-27H,6-8H2,1-5H3/b15-11+/t22-/m0/s1InChIKey
QWJDHYGTNBAXBW-QMUTUGEISA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1(3methoxypropylamino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1((3methoxypropyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6ACETYL79DIHYDROXY2(1((3METHOXYPROPYL)AMINO)ETHYLIDENE)89BDIMETHYLDIBENZO(BD)FURAN13(2H9BH)DIONE
110207025
COCCCNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
InChI=1SC22H25NO7c11018(26)16(12(3)24)2017(19(10)27)22(4)14(3020)913(25)15(21(22)28)11(2)23768295h9232627H68H215H3b1511+t22m0s1
ZINC000253412393
ZINC253412393
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