CHEBI:209586 - Bombyxamycin B

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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 Bombyxamycin B
ChEBI ID CHEBI:209586
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H31NO5
Net Charge 0
Average Mass 449.547
Monoisotopic Mass 449.22022
InChI InChI=1S/C27H31NO5/c1-21-15-11-7-5-3-4-6-8-12-16-22(29)19-23-25(31)26(32)27(2,33-23)18-14-10-9-13-17-24(30)28-20-21/h3-19,21,25-26,31-32H,20H2,1-2H3,(H,28,30)/b4-3-,7-5+,8-6-,10-9-,15-11-,16-12+,17-13-,18-14+,23-19-/t21-,25-,26+,27-/m1/s1
InChIKey WMJODBDPGQNYNL-TVIYGZMDSA-N
SMILES O=C1NC[C@@H](C=CC=CC=CC=CC=CC(C=C2O[C@](C=CC=CC=C1)([C@@H](O)[C@@H]2O)C)=O)C
Metabolite of Species Details
Streptomycesspecies (NCBI:txid1931) See: PubMed
ChEBI Ontology
Outgoing Bombyxamycin B (CHEBI:209586) is a oxolanes (CHEBI:26912)
IUPAC Name
(1R,2E,4Z,6Z,11R,12Z,14E,16Z,18Z,20E,23Z,25S,26S)-25,26-dihydroxy-1,11-dimethyl-27-oxa-9-azabicyclo[22.2.1]heptacosa-2,4,6,12,14,16,18,20,23-nonaene-8,22-dione