CHEBI:227977 - Dendrodolide B

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Dendrodolide B
ChEBI ID CHEBI:227977
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H20O5
Net Charge 0
Average Mass 256.298
Monoisotopic Mass 256.13107
InChI InChI=1S/C13H20O5/c1-9-6-12(17-2)7-10(14)4-3-5-11(15)8-13(16)18-9/h3,5,9,11-12,15H,4,6-8H2,1-2H3/t9-,11-,12-/m1/s1
InChIKey FRGUXEKVISRIEL-YUSALJHKSA-N
SMILES O=C1O[C@@H](C[C@@H](OC)CC(=O)CC=C[C@H](C1)O)C
Metabolite of Species Details
Dendrodochiumspecies (NCBI:txid2233641) See: PubMed
ChEBI Ontology
Outgoing Dendrodolide B (CHEBI:227977) is a macrolide (CHEBI:25106)
IUPAC Name
(4S,10R,12R)-4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione