Vitas-M small molecule compound
(2E,9bR)-6-acetyl-2-(1-{[1-(3,4-dimethoxyphenyl)-2-methylpropyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL547801
SMILES COc1ccc(cc1OC)C(C(C)C)N/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 C30H33NO8 MW 535.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO8/c1-13(2)25(17-9-10-19(37-7)20(11-17)38-8)31-15(4)22-18(33)12-21-30(6,29(22)36)24-27(35)14(3)26(34)23(16(5)32)28(24)39-21/h9-13,25,31,34-35H,1-8H3/b22-15+/t25?,30-/m0/s1InChIKey
DHCNRKGBDYGVMF-QKRFECDLSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl2(1((1(34dimethoxyphenyl)2methylpropyl)amino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1((1(34dimethoxyphenyl)2methylpropyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(9BRE)6ACETYL2(1((1(34DIMETHOXYPHENYL)2METHYLPROPYL)AMINO)ETHYLIDENE)79DIHYDROXY89BDIMETHYLDIBENZO(BD)FURAN13(2H9BH)DIONE
121542177
COc1ccc(cc1OC)C(C(C)C)NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
InChI=1SC30H33NO8c113(2)25(1791019(377)20(1117)388)3115(4)2218(33)122130(629(22)36)2427(35)14(3)26(34)23(16(5)32)28(24)3921h91325313435H18H3b2215+t25?30m0s1
ZINC000263585019
ZINC000263585020
Check stock
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Check stock on Vitas-MAvailable files
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