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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

Target

Structures : 2HFK

Families : Thioesterase

References (1)

Title : Structural basis for macrolactonization by the pikromycin thioesterase - Akey_2006_Nat.Chem.Biol_2_537
Author(s) : Akey DL , Kittendorf JD , Giraldes JW , Fecik RA , Sherman DH , Smith JL
Ref : Nat Chemical Biology , 2 :537 , 2006
Abstract :
PubMedSearch : Akey_2006_Nat.Chem.Biol_2_537
PubMedID: 16969372
Gene_locus related to this paper: strve-PIKAIV