CHEBI:221590 - BE-43547-C2

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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 BE-43547-C2
ChEBI ID CHEBI:221590
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H53N3O7
Net Charge 0
Average Mass 591.790
Monoisotopic Mass 591.38835
InChI InChI=1S/C32H53N3O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-25(3)30(39)32(4,41)31(40)33-22-27(36)34-24(2)20-21-28(37)35(5)23-29(38)42-26/h20-21,25-26,41H,2,6-19,22-23H2,1,3-5H3,(H,33,40)(H,34,36)/b21-20+/t25-,26-,32-/m0/s1
InChIKey VJBZHTGSHPYIDE-UFPUCTHCSA-N
SMILES O=C1N(CC(=O)O[C@H]([C@@H](C(=O)[C@@](O)(C)C(NCC(NC(C=C1)=C)=O)=O)C)CCCCCCCCCCCCCCC)C
Metabolite of Species Details
Micromonospora (NCBI:txid1873) See: PubMed
ChEBI Ontology
Outgoing BE-43547-C2 (CHEBI:221590) is a lactam (CHEBI:24995)
BE-43547-C2 (CHEBI:221590) is a macrolide (CHEBI:25106)
IUPAC Name
(6E,14S,16S,17S)-14-hydroxy-4,14,16-trimethyl-8-methylidene-17-pentadecyl-1-oxa-4,9,12-triazacycloheptadec-6-ene-2,5,10,13,15-pentone