Vitas-M small molecule compound
(4aR)-5,7-dihydroxy-8-[4-hydroxy-1-(2-methoxyethyl)-2-oxo-1,2-dihydropyrido[2,3-d]pyrimidin-7-yl]-3,4a,6-trimethyl-1-phenyl-1,4a-dihydro-4H-[1]benzofuro[3,2-f]indazol-4-one
Catalog ID
STL552584
SMILES COCCn1c(=O)nc(c2c1nc(cc2)c1c(O)c(C)c(c2c1OC1=Cc3c(C(=O)[C@]21C)c(nn3c1ccccc1)C)O)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 C32H27N5O7 MW 593.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27N5O7/c1-15-25(38)23(19-11-10-18-29(33-19)36(12-13-43-4)31(42)34-30(18)41)27-24(26(15)39)32(3)21(44-27)14-20-22(28(32)40)16(2)35-37(20)17-8-6-5-7-9-17/h5-11,14,38-39H,12-13H2,1-4H3,(H,34,41,42)/t32-/m0/s1InChIKey
JYOXZKLENHJRIR-YTTGMZPUSA-NSynonyms
(4aR)57dihydroxy8(4hydroxy1(2methoxyethyl)2oxo12dihydropyrido(23d)pyrimidin7yl)34a6trimethyl1phenyl14adihydro4H(1)benzofuro(32f)indazol4one
135640798
7((4~(a)~(R))57dihydroxy34~(a)6trimethyl4oxo1phenyl(1)benzofuro(32f)indazol8yl)1(2methoxyethyl)pyrido(23d)pyrimidine24dione
InChI=1SC32H27N5O7c11525(38)23(1911101829(3319)36(1213434)31(42)3430(18)41)2724(26(15)39)32(3)21(4427)142022(28(32)40)16(2)3537(20)178657917h511143839H1213H214H3(H344142)t32m0s1
ZINC001772493113
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