Vitas-M small molecule compound
3-hydroxy-4-(3-hydroxy-4-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK358696
SMILES COc1cc(cc(c1OC)OC)C1CC(=O)C2=C(C1)Nc1c(C2c2ccc(c(c2)O)OC)c(n[nH]1)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 C26H27N3O7 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O7/c1-33-18-6-5-12(8-16(18)30)21-22-15(27-25-23(21)26(32)29-28-25)7-13(9-17(22)31)14-10-19(34-2)24(36-4)20(11-14)35-3/h5-6,8,10-11,13,21,30H,7,9H2,1-4H3,(H3,27,28,29,32)InChIKey
RCEREDDSPORZDT-UHFFFAOYSA-NSynonyms
3hydroxy4(3hydroxy4methoxyphenyl)7(345trimethoxyphenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
4(3hydroxy4methoxyphenyl)7(345trimethoxyphenyl)246789hexahydro1Hpyrazolo(34b)quinoline35dione
COC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C(=C4)OC)OC)OC)NC5=C2C(=O)NN5)O
COc1cc(cc(c1OC)OC)C1CC(=O)C2=C(C1)Nc1c(C2c2ccc(c(c2)O)OC)c(n(nH)1)O
InChI=1SC26H27N3O7c133186512(816(18)30)212215(272523(21)26(32)292825)713(917(22)31)141019(342)24(364)20(1114)353h5681011132130H79H214H3(H327282932)
MFCD11852180
ZINC000020102602
ZINC000020102608
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