Vitas-M small molecule compound
3-hydroxy-7,7-dimethyl-4-(3,4,5-trimethoxyphenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK354385
SMILES COc1c(OC)cc(cc1OC)C1C2=C(Nc3c1c(O)n[nH]3)CC(CC2=O)(C)C
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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 C21H25N3O5 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O5/c1-21(2)8-11-16(12(25)9-21)15(17-19(22-11)23-24-20(17)26)10-6-13(27-3)18(29-5)14(7-10)28-4/h6-7,15H,8-9H2,1-5H3,(H3,22,23,24,26)InChIKey
CZVXHFGIUBQERJ-UHFFFAOYSA-NSynonyms
3hydroxy77dimethyl4(345trimethoxyphenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
77dimethyl4(345trimethoxyphenyl)124689hexahydropyrazolo(34b)quinoline35dione
CC1(CC2=C(C(C3=C(N2)NNC3=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)C1)C
COc1c(OC)cc(cc1OC)C1C2=C(Nc3c1c(O)n(nH)3)CC(CC2=O)(C)C
InChI=1SC21H25N3O5c121(2)81116(12(25)921)15(1719(2211)232420(17)26)10613(273)18(295)14(710)284h6715H89H215H3(H322232426)
MFCD11851594
ZINC000020085960
ZINC000020085962
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