Vitas-M small molecule compound

N-(3-carboxy-5-nitrophenyl)hexopyranosylamine

Catalog ID
STL525831
SMILES OCC1OC(Nc2cc(cc(c2)C(=O)O)[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 C13H16N2O9 MW 344.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O9/c16-4-8-9(17)10(18)11(19)12(24-8)14-6-1-5(13(20)21)2-7(3-6)15(22)23/h1-3,8-12,14,16-19H,4H2,(H,20,21)
InChIKey
OMJDAMXBZQGOAP-UHFFFAOYSA-N
Synonyms

3098013
3nitro5(((2R3R4S5S6R)345trihydroxy6(hydroxymethyl)tetrahydro2Hpyran2yl)amino)benzoicacid
3NITRO5((345TRIHYDROXY6(HYDROXYMETHYL)OXAN2YL)AMINO)BENZOICACID
3NITRO5(345TRIHYDROXY6HYDROXYMETHYLTETRAHYDROPYRAN2YLAMINO)BENZOIC
InChI=1SC13H16N2O9c16489(17)10(18)11(19)12(248)14615(13(20)21)27(36)15(22)23h13812141619H4H2(H2021)
MFCD00555524
N(3carboxy5nitrophenyl)hexopyranosylamine
OCC1OC(Nc2cc(cc(c2)C(=O)O)(N+)(=O)(O))C(C(C1O)O)O
ZINC000239378251
ZINC000239378258

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.