Vitas-M small molecule compound
methyl (8S,8aR,11aS,11bS)-9,11-dioxo-10-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxylate
Catalog ID
STK586325
SMILES COC(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3
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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 C22H18N2O4 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O4/c1-28-22(27)19-17-16(18-15-10-6-5-7-13(15)11-12-23(18)19)20(25)24(21(17)26)14-8-3-2-4-9-14/h2-12,16-19H,1H3/t16-,17+,18+,19-/m0/s1InChIKey
BLGPLBYDOVDAHJ-MANSERQUSA-NSynonyms
1212465-16-1(8S8aR11aS11bS)methyl911dioxo10phenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxylate
1212465161
COC(=O)(C@H)1N2C=Cc3c((C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccccc1)cccc3
COC(=O)C1C2C(C3N1C=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC=CC=C5
InChI=1SC22H18N2O4c12822(27)191716(18151065713(15)111223(18)19)20(25)24(21(17)26)148324914h2121619H1H3t1617+18+19m0s1
methyl(8S8aR11aS11bS)911dioxo10phenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxylate
MFCD18245795
ZINC000016012919
ZINC16012919
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