CHEBI:16089 - 6-deoxyerythronolide B

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ChEBI Name 6-deoxyerythronolide B
ChEBI ID CHEBI:16089
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:20715, CHEBI:41952, CHEBI:12213, CHEBI:2182
Supplier Information
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Formula C21H38O6
Net Charge 0
Average Mass 386.52282
Monoisotopic Mass 386.26684
InChI InChI=1S/C21H38O6/c1-8-16-12(4)19(24)13(5)17(22)10(2)9-11(3)18(23)14(6)20(25)15(7)21(26)27-16/h10-16,18-20,23-25H,8-9H2,1-7H3/t10-,11+,12+,13+,14-,15-,16-,18+,19+,20+/m1/s1
InChIKey HQZOLNNEQAKEHT-IBBGRPSASA-N
SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](O)[C@@H](C)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@H]1C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via erythronolide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 6-deoxyerythronolide B (CHEBI:16089) is a erythronolide (CHEBI:23955)
IUPAC Name
(3R,4S,5R,6S,7S,9R,11R,12S,13R,14R)-14-ethyl-4,6,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione
Synonyms Sources
3,5,11-Trihydroxyerythranolid-9-one ChemIDplus
6,12-Dideoxy-erythronolide A ChemIDplus
6-Deoxyerythronolide B KEGG COMPOUND
6-DEOXYERYTHRONOLIDE B PDBeChem
6-deoxyerythronolide B UniProt
Manual Xrefs Databases
C03240 KEGG COMPOUND
DB04070 DrugBank
DEB PDBeChem
LMPK04000002 LIPID MAPS
View more database links
Registry Number Type Source
15797-36-1 CAS Registry Number ChemIDplus
Last Modified
23 January 2014