Vitas-M small molecule compound
(2E,9bR)-6-acetyl-2-{1-[(8-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]ethylidene}-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL547496
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NC1CCCc2c1[nH]c1c2cccc1Cl
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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 C30H27ClN2O6 MW 547.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27ClN2O6/c1-12-26(36)22(14(3)34)28-23(27(12)37)30(4)20(39-28)11-19(35)21(29(30)38)13(2)32-18-10-6-8-16-15-7-5-9-17(31)24(15)33-25(16)18/h5,7,9,11,18,32-33,36-37H,6,8,10H2,1-4H3/b21-13+/t18?,30-/m0/s1InChIKey
ABURYXLXMAEFFA-FNKZDUQTSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl2(1((8chloro2349tetrahydro1~(H)carbazol1yl)amino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1((8chloro2349tetrahydro1Hcarbazol1yl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(9bRE)6acetyl2(1((8chloro2349tetrahydro1Hcarbazol1yl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
121541843
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NC1CCCc2c1(nH)c1c2cccc1Cl
InChI=1SC30H27ClN2O6c11226(36)22(14(3)34)2823(27(12)37)30(4)20(3928)1119(35)21(29(30)38)13(2)32181068161575917(31)24(15)3325(16)18h579111832333637H6810H214H3b2113+t18?30m0s1
ZINC000263584744
ZINC000263584745
Check stock
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Check stock on Vitas-MAvailable files
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