Vitas-M small molecule compound

diphenylmethyl (6aR,6bS,9aR,10S)-8-(2,3-dihydro-1,4-benzodioxin-6-yl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate

Catalog ID
STK541667
SMILES O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1

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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 C36H28N2O6 MW 584.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H28N2O6/c39-34-30-27-17-15-22-9-7-8-14-26(22)38(27)32(31(30)35(40)37(34)25-16-18-28-29(21-25)43-20-19-42-28)36(41)44-33(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-18,21,27,30-33H,19-20H2/t27-,30-,31-,32+/m1/s1
InChIKey
SKHFXPRAZZUMCC-JMSBNOGBSA-N
Synonyms

(6aR6bS9aR10S)benzhydryl8(23dihydrobenzo(b)(14)dioxin6yl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
C1COC2=C(O1)C=CC(=C2)N3C(=O)C4C5C=CC6=CC=CC=C6N5C(C4C3=O)C(=O)OC(C7=CC=CC=C7)C8=CC=CC=C8
diphenylmethyl(6aR6bS9aR10S)8(23dihydro14benzodioxin6yl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
InChI=1SC36H28N2O6c393430271715229781426(22)38(27)32(31(30)35(40)37(34)2516182829(2125)4320194228)36(41)4433(23103141123)24125261324h11821273033H1920H2t27303132+m1s1
MFCD18241918
O=C((C@H)1N2(C@@H)((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1
ZINC000102430733
ZINC102430733

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Available files

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