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CHEBI:207155 - Abybetaomicin Q

Default Structure
ChEBI IDCHEBI:207155
ChEBI NameAbybetaomicin Q
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O8
Net Charge0
Average Mass394.420
Monoisotopic Mass394.16277
SMILESC[C@H]1C[C@](C)(O)C(=O)[C@@H]2[C@@H](O)[C@H]3[C@H](O)[C@@]4(C)O[C@@]25C(=C1O)C(=O)O[C@@]35C[C@@H]4C
InChIInChI=1S/C20H26O8/c1-7-5-17(3,26)14(23)10-13(22)9-15(24)18(4)8(2)6-19(9)20(10,28-18)11(12(7)21)16(25)27-19/h7-10,13,15,21-22,24,26H,5-6H2,1-4H3/t7-,8-,9-,10-,13-,15-,17-,18-,19-,20+/m0/s1
InChIKeyMVFRGMBYWIQNOX-KAADVHEXSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies LC-6-2 (ncbitaxon:1676287) - PubMed (28358212)
ChEBI Ontology
Outgoing Relation(s)
Abybetaomicin Q (CHEBI:207155) is a furopyran (CHEBI:74927)
IUPAC Name 
(1S,2S,3S,4S,5R,7S,9S,14S,16S,18R)-2,4,7,10-tetrahydroxy-1,7,9,16-tetramethyl-13,17-dioxapentacyclo[9.5.2.03,14.05,18.014,18]octadec-10-ene-6,12-dione