Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-2-(1-{[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino}ethylidene)-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL548099
SMILES COc1ccc(cc1)OCC(CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)O
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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 C28H29NO9 MW 523.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO9/c1-13-24(33)22(15(3)30)26-23(25(13)34)28(4)20(38-26)10-19(32)21(27(28)35)14(2)29-11-16(31)12-37-18-8-6-17(36-5)7-9-18/h6-10,16,29,31,33-34H,11-12H2,1-5H3/b21-14+/t16?,28-/m0/s1InChIKey
PNGKKAVHZKYGNS-NEPICRLWSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1((2hydroxy3(4methoxyphenoxy)propyl)amino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1((2hydroxy3(4methoxyphenoxy)propyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(9bRE)6acetyl79dihydroxy2(1((2hydroxy3(4methoxyphenoxy)propyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
110206053
COc1ccc(cc1)OCC(CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C)O
InChI=1SC28H29NO9c11324(33)22(15(3)30)2623(25(13)34)28(4)20(3826)1019(32)21(27(28)35)14(2)291116(31)1237188617(365)7918h6101629313334H1112H215H3b2114+t16?28m0s1
ZINC000253411992
ZINC000253411993
Check stock
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