Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-[4-chloro-3-(trifluoromethyl)phenyl]-10-[(3-nitrophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK556366
SMILES O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(c(c1)C(F)(F)F)Cl)C=Cc1c2cccc1)c1cccc(c1)[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 C28H17ClF3N3O5 MW 567.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H17ClF3N3O5/c29-19-10-9-16(13-18(19)28(30,31)32)33-26(37)22-21-11-8-14-4-1-2-7-20(14)34(21)24(23(22)27(33)38)25(36)15-5-3-6-17(12-15)35(39)40/h1-13,21-24H/t21-,22-,23-,24+/m1/s1InChIKey
KAMVSGGANDFDTA-YCAMKHIRSA-NSynonyms
(6aR6bS9aR10S)8(4chloro3(trifluoromethyl)phenyl)10((3nitrophenyl)carbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(4chloro3(trifluoromethyl)phenyl)10(3nitrobenzoyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
C1=CC=C2C(=C1)C=CC3N2C(C4C3C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)C(F)(F)F)C(=O)C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC28H17ClF3N3O5c291910916(1318(19)28(3031)32)3326(37)222111814412720(14)34(21)24(23(22)27(33)38)25(36)1553617(1215)35(39)40h1132124Ht21222324+m1s1
MFCD18242936
O=C((C@H)1N2(C@@H)((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc(c(c1)C(F)(F)F)Cl)C=Cc1c2cccc1)c1cccc(c1)(N+)(=O)(O)
ZINC000102473854
ZINC102473854
Check stock
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Check stock on Vitas-MAvailable files
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