Vitas-M small molecule compound
(2E,9bR)-6-acetyl-2-{1-[(bicyclo[2.2.1]hept-5-en-2-ylmethyl)amino]ethylidene}-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL547267
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCC1CC2CC1C=C2
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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 C26H27NO6 MW 449.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO6/c1-11-22(30)20(13(3)28)24-21(23(11)31)26(4)18(33-24)9-17(29)19(25(26)32)12(2)27-10-16-8-14-5-6-15(16)7-14/h5-6,9,14-16,27,30-31H,7-8,10H2,1-4H3/b19-12+/t14?,15?,16?,26-/m0/s1InChIKey
RKLPDXJXDHQOFO-CBEOOLRISA-NSynonyms
(2~(E)9~(b)~(R))6acetyl2(1(2bicyclo(221)hept5enylmethylamino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1((bicyclo(221)hept5en2ylmethyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(9bRE)6acetyl2(1(((2R)bicyclo(221)hept5en2ylmethyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110207201
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NCC1CC2CC1C=C2
InChI=1SC26H27NO6c11122(30)20(13(3)28)2421(23(11)31)26(4)18(3324)917(29)19(25(26)32)12(2)2710168145615(16)714h5691416273031H7810H214H3b1912+t14?15?16?26m0s1
ZINC000253412574
ZINC000253412575
Check stock
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