Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-[(4-bromophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK544471
SMILES Brc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1
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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 C28H19BrN2O5 MW 543.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19BrN2O5/c29-17-8-5-16(6-9-17)26(32)25-24-23(20-11-7-15-3-1-2-4-19(15)31(20)25)27(33)30(28(24)34)18-10-12-21-22(13-18)36-14-35-21/h1-13,20,23-25H,14H2/t20-,23-,24-,25+/m1/s1InChIKey
KEWGLFXQMSGIMW-HVHOJJEHSA-NSynonyms
956793-63-8(6aR6bS9aR10S)8(13benzodioxol5yl)10((4bromophenyl)carbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(benzo(d)(13)dioxol5yl)10(4bromobenzoyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
956793638
Brc1ccc(cc1)C(=O)(C@H)1N2(C@@H)((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4C5C=CC6=CC=CC=C6N5C(C4C3=O)C(=O)C7=CC=C(C=C7)Br
InChI=1SC28H19BrN2O5c29178516(6917)26(32)252423(2011715312419(15)31(20)25)27(33)30(28(24)34)1810122122(1318)36143521h113202325H14H2t20232425+m1s1
MFCD18242154
ZINC000100862679
ZINC100862679
Check stock
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Check stock on Vitas-MAvailable files
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