CHEBI:65412 - ansaetherone

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ChEBI Name ansaetherone
ChEBI ID CHEBI:65412
Definition An 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H33NO7
Net Charge 0
Average Mass 471.54270
Monoisotopic Mass 471.22570
InChI InChI=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
InChIKey JSYTVJCZLSFGTM-HNLRCUENSA-N
SMILES [H][C@@]1(CC[C@@H](O)[C@@H](C)O1)O[C@H]1[C@H](C)[C@]2([H])Oc3c(NC(=O)C(C)C(=O)C(=C/C)\C=C2/C)cc(O)cc13
Metabolite of Species Details
Streptomyces sp. (NCBI:txid1931) of strain USF 4727 See: PubMed
Roles Classification
Chemical Role(s): radical scavenger
A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 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
Last Modified
01 June 2018