Vitas-M small molecule compound
(12bS)-9-acetyl-10,12-dihydroxy-5,11,12b-trimethyl[1]benzofuro[2,3-h]pyrazolo[1,5-a]quinazolin-6(12bH)-one
Catalog ID
STL549056
SMILES CC(=O)c1c2OC3=CC(=O)c4c([C@@]3(c2c(c(c1O)C)O)C)n1nccc1nc4C
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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 C21H17N3O5 MW 391.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O5/c1-8-17(27)15(10(3)25)19-16(18(8)28)21(4)12(29-19)7-11(26)14-9(2)23-13-5-6-22-24(13)20(14)21/h5-7,27-28H,1-4H3/t21-/m0/s1InChIKey
UGVKFVJDNIQJMT-NRFANRHFSA-NSynonyms
(1~(S))16acetyl1719dihydroxy1918trimethyl14oxa348triazapentacyclo(11700^(210)0^(37)0^(1520))icosa2(10)46812151719octaen11one
(12bS)9acetyl1012dihydroxy51112btrimethyl(1)benzofuro(23h)pyrazolo(15a)quinazolin6(12bH)one
(S)9acetyl1012dihydroxy51112btrimethylbenzofuro(23h)pyrazolo(15a)quinazolin6(12bH)one
110207954
CC(=O)c1c2OC3=CC(=O)c4c((C@@)3(c2c(c(c1O)C)O)C)n1nccc1nc4C
InChI=1SC21H17N3O5c1817(27)15(10(3)25)1916(18(8)28)21(4)12(2919)711(26)149(2)2313562224(13)20(14)21h572728H14H3t21m0s1
ZINC000253413251
ZINC253413251
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