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Substrate Report for: 10-Deoxymethynolide

The aglycone of the macrolide antibiotic 10-deoxymethymycin


General
Type Polyketide, Macrolide
Chemical_Nomenclature (3R,4S,5S,7R,9E,11R,12R)-12-ethyl-4-hydroxy-3,5,7,11-tetramethyl-1-oxacyclododec-9-ene-2,8-dione
Canonical SMILES CCC1C(C=CC(=O)C(CC(C(C(C(=O)O1)C)O)C)C)C
InChI InChI=1S/C17H28O4/c1-6-15-10(2)7-8-14(18)11(3)9-12(4)16(19)13(5)17(20)21-15/h7-8,10-13,15-16,19H,6,9H2,1-5H3/b8-7+/t10-,11-,12+,13-,15-,16+/m1/s1
InChIKey NZUJVBSYQXETNF-PQWITYJESA-N
Other name(s) E4H ; DB07703 ; 81644-19-1 ; (3R,4S,5S,7R,9E,11R,12R)-12-ethyl-4-hydroxy-3,5,7,11-tetramethyloxacyclododec-9-ene-2,8-dione ; AC1NQZDU ; SCHEMBL2880039 ; CHEBI:29461
________________________________________________________________________________________________
MW|296.40
Formula|C17H28O4
CAS_number|
PubChem|5282031
UniChem|NZUJVBSYQXETNF-PQWITYJESA-N
IUPHAR|
Wikipedia|

Target
Families | 10-Deoxymethynolide ligand of proteins in family: Thioesterase
Stucture | 1 structure: 2HFK: Pikromycin thioesterase in complex with product 10-deoxymethynolide
Protein | strve-PIKAIV

References:
Search PubMed for references concerning: 10-Deoxymethynolide
    Title: Structural basis for macrolactonization by the pikromycin thioesterase
    Akey DL, Kittendorf JD, Giraldes JW, Fecik RA, Sherman DH, Smith JL
    Ref: Nat Chemical Biology, 2:537, 2006 : PubMed