LIPID MAPS

Common Name

Gladiolin

Systematic Name

Synonyms

LM ID

LMPK04000045

Status

Active

Exact Mass

Calculate m/z

778.523115

Formula

C₄₄H₇₄O₁₁

Show lipids differing only in stereochemistry/bond geometry

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MDLMOL SDF CSV TSV

MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Classification

String Representations

InChiKey (Click to copy)

YDAASCQXIKRLNG-RYVJNYSNSA-N

InChi (Click to copy)

InChI=1S/C44H74O11/c1-30(17-12-8-7-9-14-19-35(45)25-31(2)23-24-43(51)52)26-39(48)34(5)42-27-36(46)20-16-22-37(54-6)21-15-11-10-13-18-32(3)38(47)28-40(49)33(4)41(50)29-44(53)55-42/h7-11,13-15,26,31-42,45-50H,12,16-25,27-29H2,1-6H3,(H,51,52)/b8-7+,13-10+,14-9+,15-11-,30-26+/t31?,32-,33-,34+,35?,36+,37+,38-,39+,40+,41+,42-/m0/s1

SMILES (Click to copy)

C(CCC(C)CC(O)C/C=C/C=C/CC/C(/C)=C/[C@@H](O)[C@@H](C)[C@@H]1C[C@H](O)CCC[C@H](OC)CC=CC=CC[C@@H]([C@H](C[C@@H](O)[C@H](C)[C@@H](CC(O1)=O)O)O)C)(=O)O

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Burkholderia gladioli (#28095)

Betaproteobacteria (#28216)

Discovery and Biosynthesis of Gladiolin: A Burkholderia gladioli Antibiotic with Promising Activity against Mycobacterium tuberculosis.,
J Am Chem Soc, 2017

Pubmed ID: 28528545