Vitas-M small molecule compound
2,6-dihydroxy-7'-nitro-2'-phenyl-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-4-one
Catalog ID
STK575126
SMILES OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CC(C1)c1ccccc1)[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 C21H18N4O5 MW 406.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O5/c26-18-21(19(27)23-20(28)22-18)10-13-8-15(25(29)30)6-7-16(13)24-11-14(9-17(21)24)12-4-2-1-3-5-12/h1-8,14,17H,9-11H2,(H2,22,23,26,27,28)InChIKey
IPYSYVUCZZMGFX-UHFFFAOYSA-NSynonyms
902307-62-426dihydroxy7nitro2phenyl1233atetrahydro4H5Hspiro(pyrimidine54pyrrolo(12a)quinolin)4one
7nitro2phenylspiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
902307624
C1C(CN2C1C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)NC3=O)C5=CC=CC=C5
InChI=1SC21H18N4O5c261821(19(27)2320(28)2218)1013815(25(29)30)6716(13)241114(917(21)24)124213512h181417H911H2(H22223262728)
MFCD07207616
OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CC(C1)c1ccccc1)(N+)(=O)(O)
ZINC000009011785
ZINC000017014261
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