CHEBI:216166 - Abybetaomicin K

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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 Abybetaomicin K
ChEBI ID CHEBI:216166
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H24O7
Net Charge 0
Average Mass 364.394
Monoisotopic Mass 364.15220
InChI InChI=1S/C19H24O7/c1-6-4-7(2)13(21)11-17(24)26-18-5-8(3)16-15(23)9(18)14(22)10(12(6)20)19(11,18)25-16/h6-10,14-16,21-23H,4-5H2,1-3H3/t6-,7+,8+,9?,10-,14+,15-,16?,18+,19-/m0/s1
InChIKey VUYKDEHGBXWVQB-BPJYVAKCSA-N
SMILES O=C1[C@H](C[C@H](C(O)=C2[C@]34[C@@H]1[C@H](O)C5[C@H](O)C(O3)[C@H](C)C[C@]45OC2=O)C)C
Metabolite of Species Details
Verrucosisporaspecies MS100128 (NCBI:txid1171889) See: PubMed
ChEBI Ontology
Outgoing Abybetaomicin K (CHEBI:216166) is a furopyran (CHEBI:74927)
IUPAC Name
(2S,4R,5S,7S,9R,14R,16R,18S)-2,4,10-trihydroxy-7,9,16-trimethyl-13,17-dioxapentacyclo[9.5.2.03,14.05,18.014,18]octadec-10-ene-6,12-dione