Vitas-M small molecule compound

N-(2-methyl-4-nitrophenyl)hexopyranosylamine

Catalog ID
STK751374
SMILES OCC1OC(Nc2ccc(cc2C)[N+](=O)[O-])C(C(C1O)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 C13H18N2O7 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N2O7/c1-6-4-7(15(20)21)2-3-8(6)14-13-12(19)11(18)10(17)9(5-16)22-13/h2-4,9-14,16-19H,5H2,1H3
InChIKey
WVPFNBBQRHGUHM-UHFFFAOYSA-N
Synonyms

(2R3S4S5S)2(hydroxymethyl)6((2methyl4nitrophenyl)amino)tetrahydro2Hpyran345triol
2(HYDROXYMETHYL)6(2METHYL4NITROANILINO)OXANE345TRIOL
2HYDROXYMETHYL6(2METHYL4NITROPHENYLAMINO)TETRAHYDROPYRAN345TRIOL
CC1=C(C=CC(=C1)(N+)(=O)(O))NC2C(C(C(C(O2)CO)O)O)O
InChI=1SC13H18N2O7c1647(15(20)21)238(6)141312(19)11(18)10(17)9(516)2213h249141619H5H21H3
MFCD00746932
N(2methyl4nitrophenyl)hexopyranosylamine
OC(C@H)1OC(Nc2ccc(cc2C)(N+)(=O)(O))(C@H)((C@H)((C@@H)1O)O)O
OCC1OC(Nc2ccc(cc2C)(N+)(=O)(O))C(C(C1O)O)O
ZINC000138092875
ZINC000239432905

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Available files

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