Vitas-M small molecule compound
(2S,7'R)-7-chloro-4'-(furan-2-yl)-4,6-dimethoxy-7'-methyl-1'-(propan-2-yl)-1',2',4',7',8',9'-hexahydro-3H-spiro[1-benzofuran-2,6'-pyrazolo[3,4-b]quinoline]-3,3',5'-trione
Catalog ID
STL550644
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC2=C(C1=O)C(c1ccco1)c1c(N2)n([nH]c1=O)C(C)C)Cl
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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 C27H26ClN3O7 MW 539.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O7/c1-11(2)31-25-20(26(34)30-31)18(14-7-6-8-37-14)17-13(29-25)9-12(3)27(23(17)32)24(33)19-15(35-4)10-16(36-5)21(28)22(19)38-27/h6-8,10-12,18,29H,9H2,1-5H3,(H,30,34)/t12-,18?,27+/m1/s1InChIKey
MFDZVHBJJRKJSP-BDIZYUCNSA-NSynonyms
(2~(S)7~(R))7chloro4(furan2yl)46dimethoxy7methyl1propan2ylspiro(1benzofuran264789tetrahydro2~(H)pyrazolo(34b)quinoline)335trione
(2S7R)7chloro4(furan2yl)1isopropyl46dimethoxy7methyl1278tetrahydro3Hspiro(benzofuran26pyrazolo(34b)quinoline)335(4H9H)trione
(2S7R)7chloro4(furan2yl)46dimethoxy7methyl1(propan2yl)124789hexahydro3Hspiro(1benzofuran26pyrazolo(34b)quinoline)335trione
132352313
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC2=C(C1=O)C(c1ccco1)c1c(N2)n((nH)c1=O)C(C)C)Cl
InChI=1SC27H26ClN3O7c111(2)312520(26(34)3031)18(147683714)1713(2925)912(3)27(23(17)32)24(33)1915(354)1016(365)21(28)22(19)3827h6810121829H9H215H3(H3034)t1218?27+m1s1
ZINC000824567114
ZINC000824567115
Check stock
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Check stock on Vitas-MAvailable files
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