Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-10-acetyl-8-(2-methoxy-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK538731
SMILES COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)C)[N+](=O)[O-]
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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 C23H19N3O6 MW 433.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O6/c1-12(27)21-20-19(16-9-7-13-5-3-4-6-15(13)24(16)21)22(28)25(23(20)29)17-11-14(26(30)31)8-10-18(17)32-2/h3-11,16,19-21H,1-2H3/t16-,19-,20-,21-/m1/s1InChIKey
LSBXBYVHMIJRLS-QYRPDUKASA-NSynonyms
955976-74-6(6aR6bS9aR10S)10acetyl8(2methoxy5nitrophenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
955976746
CC(=O)C1C2C(C3N1C4=CC=CC=C4C=C3)C(=O)N(C2=O)C5=C(C=CC(=C5)(N+)(=O)(O))OC
COc1ccc(cc1N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2C=Cc2c1cccc2)C(=O)C)(N+)(=O)(O)
InChI=1SC23H19N3O6c112(27)212019(169713534615(13)24(16)21)22(28)25(23(20)29)171114(26(30)31)81018(17)322h311161921H12H3t16192021m1s1
MFCD18241714
ZINC000013551731
ZINC13551731
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Check stock on Vitas-MAvailable files
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