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CHEBI:207149 - Abybetaomicin P

ChEBI IDCHEBI:207149
ChEBI NameAbybetaomicin P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O8
Net Charge0
Average Mass408.447
Monoisotopic Mass408.17842
SMILESCO[C@H]1[C@H]2[C@H](O)[C@@]3(C)O[C@@]45C(=C(O)[C@@H](C)C[C@](C)(O)C(=O)[C@H]14)C(=O)O[C@@]25C[C@@H]3C
InChIInChI=1S/C21H28O8/c1-8-6-18(3,26)15(23)12-14(27-5)11-16(24)19(4)9(2)7-20(11)21(12,29-19)10(13(8)22)17(25)28-20/h8-9,11-12,14,16,22,24,26H,6-7H2,1-5H3/t8-,9-,11-,12-,14-,16-,18-,19-,20-,21-/m0/s1
InChIKeyHRQVZXBGBCUWQA-IIYJEMGZSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies LC-6-2 (ncbitaxon:1676287) - PubMed (28358212)
ChEBI Ontology
Outgoing Relation(s)
Abybetaomicin P (CHEBI:207149) is a furopyran (CHEBI:74927)
IUPAC Name 
(1S,2S,3R,4S,5R,7S,9S,14S,16S,18R)-2,7,10-trihydroxy-4-methoxy-1,7,9,16-tetramethyl-13,17-dioxapentacyclo[9.5.2.03,14.05,18.014,18]octadec-10-ene-6,12-dione