Vitas-M small molecule compound
4-acetylphenyl (6aS,6bR,9aS,10R)-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
STL536858
SMILES O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1)Oc1ccc(cc1)C(=O)C
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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 C31H24N2O7 MW 536.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24N2O7/c1-17(34)18-6-10-21(11-7-18)40-31(37)28-27-26(23-12-8-19-4-2-3-5-22(19)33(23)28)29(35)32(30(27)36)20-9-13-24-25(16-20)39-15-14-38-24/h2-13,16,23,26-28H,14-15H2,1H3/t23-,26-,27-,28+/m0/s1InChIKey
NBDQXFCQFCHTCC-QWMXJGQVSA-NSynonyms
956819-54-8(4acetylphenyl)(10~(S)11~(R)15~(S)16~(R))13(23dihydro14benzodioxin6yl)1214dioxo113diazatetracyclo(8600^(27)0^(1115))hexadeca2468tetraene16carboxylate
(6aS6bR9aS10R)4acetylphenyl8(23dihydrobenzo(b)(14)dioxin6yl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
16397791
4acetylphenyl(6aS6bR9aS10R)8(23dihydro14benzodioxin6yl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
956819548
InChI=1SC31H24N2O7c117(34)1861021(11718)4031(37)282726(2312819423522(19)33(23)28)29(35)32(30(27)36)209132425(1620)3915143824h21316232628H1415H21H3t23262728+m0s1
MFCD03267276
O=C((C@@H)1N2(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1)Oc1ccc(cc1)C(=O)C
ZINC000070672700
ZINC70672700
Check stock
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