Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-(1-{[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)benzyl]amino}ethylidene)dibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL548843
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCc1ccc(cc1)c1oc2c(n1)nccc2
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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 C31H25N3O7 MW 551.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N3O7/c1-14-25(37)23(16(3)35)27-24(26(14)38)31(4)21(41-27)12-19(36)22(28(31)39)15(2)33-13-17-7-9-18(10-8-17)30-34-29-20(40-30)6-5-11-32-29/h5-12,33,37-38H,13H2,1-4H3/b22-15+/t31-/m0/s1InChIKey
BHEMAJLFOFTHLY-LCODUHMFSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl2(1((4((13)oxazolo(45b)pyridin2yl)phenyl)methylamino)ethylidene)dibenzofuran13dione
(2E9bR)6acetyl79dihydroxy89bdimethyl2(1((4((13)oxazolo(45b)pyridin2yl)benzyl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl79dihydroxy89bdimethyl2(1((4(oxazolo(45b)pyridin2yl)benzyl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
110207639
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NCc1ccc(cc1)c1oc2c(n1)nccc2
InChI=1SC31H25N3O7c11425(37)23(16(3)35)2724(26(14)38)31(4)21(4127)1219(36)22(28(31)39)15(2)3313177918(10817)30342920(4030)65113229h512333738H13H214H3b2215+t31m0s1
ZINC000253396854
ZINC253396854
Check stock
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Check stock on Vitas-MAvailable files
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