Vitas-M small molecule compound
2-amino-6-(hydroxymethyl)-4-(6-nitro-1,3-benzodioxol-5-yl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Catalog ID
STK774076
SMILES N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1[N+](=O)[O-])oc(cc2=O)CO
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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 C17H11N3O8 MW 385.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11N3O8/c18-4-9-14(8-2-12-13(26-6-25-12)3-10(8)20(23)24)16-15(28-17(9)19)11(22)1-7(5-21)27-16/h1-3,14,21H,5-6,19H2InChIKey
CJVXQZIBKPTGAG-UHFFFAOYSA-NSynonyms
625376-12-72amino6(hydroxymethyl)4(6nitro13benzodioxol5yl)8oxo48dihydropyrano(32b)pyran3carbonitrile
2AMINO6(HYDROXYMETHYL)4(6NITRO13BENZODIOXOL5YL)8OXO4HPYRANO(32B)PYRAN3CARBONITRILE
2amino6(hydroxymethyl)4(6nitrobenzo(d)(13)dioxol5yl)8oxo48dihydropyrano(32b)pyran3carbonitrile
625376127
C1OC2=C(O1)C=C(C(=C2)C3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N)(N+)(=O)(O)
InChI=1SC17H11N3O8c184914(821213(2662512)310(8)20(23)24)1615(2817(9)19)11(22)17(521)2716h131421H5619H2
MFCD03730787
N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1(N+)(=O)(O))oc(cc2=O)CO
ZINC000001873234
ZINC000001873235
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