CHEBI:206868 - Flavofungin I

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Flavofungin I
ChEBI ID CHEBI:206868
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C36H58O10
Net Charge 0
Average Mass 650.850
Monoisotopic Mass 650.40300
InChI InChI=1S/C36H58O10/c1-24(2)36-25(3)16-17-27(37)18-28(38)19-29(39)20-30(40)21-31(41)22-32(42)23-34(44)26(4)33(43)14-12-10-8-6-5-7-9-11-13-15-35(45)46-36/h5-13,15-17,24-34,36-44H,14,18-23H2,1-4H3/b7-5-,8-6-,11-9-,12-10-,15-13-,17-16-/t25-,26-,27-,28-,29+,30-,31+,32+,33-,34+,36-/m0/s1
InChIKey GBVIQYQFMPWELT-FFWPGOQVSA-N
SMILES O=C1O[C@H]([C@H](C=C[C@H](O)C[C@H](O)C[C@@H](O)C[C@H](O)C[C@@H](O)C[C@@H](O)C[C@H]([C@H]([C@H](CC=CC=CC=CC=CC=C1)O)C)O)C)C(C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Flavofungin I (CHEBI:206868) is a macrolide (CHEBI:25106)
IUPAC Name
(3Z,5E,7E,9E,11E,14S,15S,16R,18R,20R,22S,24S,26R,28R,29E,31S,32S)-14,16,18,20,22,24,26,28-octahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11,29-hexaen-2-one