Vitas-M small molecule compound

(6E)-2,3,4,5-tetrahydroxy-6-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]hexanoic acid (non-preferred name)

Catalog ID
STL328701
SMILES OC(C(C(C(C(=O)O)O)O)O)/C=N/NC(=O)c1ccncc1

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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 C12H15N3O7 MW 313.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O7/c16-7(8(17)9(18)10(19)12(21)22)5-14-15-11(20)6-1-3-13-4-2-6/h1-5,7-10,16-19H,(H,15,20)(H,21,22)/b14-5+
InChIKey
WREFPPXAWHSISP-LHHJGKSTSA-N
Synonyms

(6E)2345tetrahydroxy6(2(pyridin4ylcarbonyl)hydrazinylidene)hexanoicacid(nonpreferredname)
(6E)2345tetrahydroxy6(pyridine4carbonylhydrazinylidene)hexanoicacid
2345tetrahydroxy6(2isonicotinoylhydrazono)hexanoicacid
C1=CN=CC=C1C(=O)NN=CC(C(C(C(C(=O)O)O)O)O)O
InChI=1SC12H15N3O7c167(8(17)9(18)10(19)12(21)22)5141511(20)61313426h157101619H(H1520)(H2122)b145+
MFCD00369388
OC(C(C(C(C(=O)O)O)O)O)C=NNC(=O)c1ccncc1
ZINC000004539126
ZINC000226934480

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Available files

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