Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Catalog ID
STL527335
SMILES O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)N)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 C22H17N3O5 MW 403.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O5/c23-20(26)19-18-17(14-7-5-11-3-1-2-4-13(11)25(14)19)21(27)24(22(18)28)12-6-8-15-16(9-12)30-10-29-15/h1-9,14,17-19H,10H2,(H2,23,26)/t14-,17-,18-,19+/m1/s1InChIKey
TWZVPEFMBBUEMX-AXUOBQJMSA-NSynonyms
956237-56-2(10~(R)11~(S)15~(R)16~(S))13(13benzodioxol5yl)1214dioxo113diazatetracyclo(8600^(27)0^(1115))hexadeca2468tetraene16carboxamide
(6aR6bS9aR10S)8(13benzodioxol5yl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxamide
(6aR6bS9aR10S)8(benzo(d)(13)dioxol5yl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxamide
6573361
956237562
InChI=1SC22H17N3O5c2320(26)191817(147511312413(11)25(14)19)21(27)24(22(18)28)12681516(912)30102915h19141719H10H2(H22326)t14171819+m1s1
MFCD03267782
O=C1N(c2ccc3c(c2)OCO3)C(=O)(C@@H)2(C@H)1(C@H)1C=Cc3c(N1(C@@H)2C(=O)N)cccc3
ZINC000003999670
ZINC3999670
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.