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CHEBI:65412 - ansaetherone

ChEBI IDCHEBI:65412
ChEBI Nameansaetherone
Stars
DefinitionAn eleven-membered macrocyclic lactam that consists of (2S,3E,5Z,14S,15R)-5-ethylidene-11,14-dihydroxy-3,7,15-trimethyl-2,5-dihydro-2,13-ethano-1,9-benzoxazacycloundecine-6,8-dione in which the 14-hydroxy group is substituted by a (2R,5R,6R)-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl moiety. It is a radical scavenger isolated from Streptomyces.
Last Modified1 June 2018
DownloadsMolfile
FormulaC26H33NO7
Net Charge0
Average Mass471.550
Monoisotopic Mass471.22570
SMILES[H][C@]1(O[C@@H]2c3cc(O)cc4c3O[C@]([H])(/C(C)=C/C(=C/C)C(=O)C(C)C(=O)N4)[C@H]2C)CC[C@@H](O)[C@@H](C)O1
InChIInChI=1S/C26H33NO7/c1-6-16-9-12(2)23-14(4)24(33-21-8-7-20(29)15(5)32-21)18-10-17(28)11-19(25(18)34-23)27-26(31)13(3)22(16)30/h6,9-11,13-15,20-21,23-24,28-29H,7-8H2,1-5H3,(H,27,31)/b12-9+,16-6-/t13?,14-,15-,20-,21+,23-,24+/m1/s1
InChIKeyJSYTVJCZLSFGTM-HNLRCUENSA-N
Species of MetaboliteComponentSourceComments
Streptomyces sp. (ncbitaxon:1931) - PubMed (18776684) Strain: USF 4727
Roles Classification
Chemical Role:
radical scavenger  A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
ansaetherone (CHEBI:65412) has role metabolite (CHEBI:25212)
ansaetherone (CHEBI:65412) has role radical scavenger (CHEBI:48578)
ansaetherone (CHEBI:65412) is a glycoside (CHEBI:24400)
ansaetherone (CHEBI:65412) is a lactam (CHEBI:24995)
ansaetherone (CHEBI:65412) is a macrocycle (CHEBI:51026)
ansaetherone (CHEBI:65412) is a monosaccharide derivative (CHEBI:63367)
ansaetherone (CHEBI:65412) is a phenols (CHEBI:33853)
IUPAC Name 
(2S,3E,5Z,14S,15R)-5-ethylidene-11-hydroxy-14-{[(2R,5R,6R)-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3,7,15-trimethyl-2,5-dihydro-2,13-ethano-1,9-benzoxazacycloundecine-6,8(7H,9H)-dione