CHEBI:207108 - Abybetaomicin V

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 Abybetaomicin V
ChEBI ID CHEBI:207108
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H26O7
Net Charge 0
Average Mass 378.421
Monoisotopic Mass 378.16785
InChI InChI=1S/C20H26O7/c1-9-6-10(2)15(23)14-17-20(27-18(14)25)7-11(8-21)19(3,26-17)16(24)12(20)4-5-13(9)22/h9-12,16,21,24H,4-8H2,1-3H3/t9-,10+,11-,12+,16+,19+,20+/m1/s1
InChIKey ZTMDLJADCRURSE-KJXJVICLSA-N
SMILES O=C1C=2C(=O)O[C@]34C2O[C@]([C@@H](O)[C@@H]3CCC([C@@H](C[C@@H]1C)C)=O)([C@@H](CO)C4)C
Metabolite of Species Details
Streptomycesspecies LC-6-2 (NCBI:txid1676287) See: PubMed
ChEBI Ontology
Outgoing Abybetaomicin V (CHEBI:207108) is a oxanes (CHEBI:46942)
IUPAC Name
(1S,2S,3S,7R,9S,14S,16R)-2-hydroxy-16-(hydroxymethyl)-1,7,9-trimethyl-13,17-dioxatetracyclo[9.5.2.03,14.014,18]octadec-11(18)-ene-6,10,12-trione