Vitas-M small molecule compound
butyl 4-[8-(furan-2-ylcarbonyl)-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]benzoate
Catalog ID
STL232171
SMILES CCCCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2c2ccccc2C=C1)C(=O)c1ccco1
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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 C30H26N2O6 MW 510.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O6/c1-2-3-16-38-30(36)19-10-12-20(13-11-19)32-28(34)23-24(29(32)35)26(27(33)22-9-6-17-37-22)31-15-14-18-7-4-5-8-21(18)25(23)31/h4-15,17,23-26H,2-3,16H2,1H3InChIKey
HUFNATHZLQQDAQ-UHFFFAOYSA-NSynonyms
butyl4((8S8aR11aS)8(furan2carbonyl)911dioxo8a91111atetrahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinolin10(11bH)yl)benzoate
butyl4(8(furan2ylcarbonyl)911dioxo8a911a11btetrahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinolin10(11H)yl)benzoate
CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=CO6
CCCCOC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1C2c2ccccc2C=C1)C(=O)c1ccco1
InChI=1SC30H26N2O6c123163830(36)19101220(131119)3228(34)2324(29(32)35)26(27(33)2296173722)31151418745821(18)25(23)31h415172326H2316H21H3
MFCD07202916
ZINC000015989971
ZINC000248154702
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