EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:205079 - Hypogeamicin C

ChEBI IDCHEBI:205079
ChEBI NameHypogeamicin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H23NO8
Net Charge0
Average Mass393.392
Monoisotopic Mass393.14237
SMILESCCC[C@H]1O[C@H](CC(N)=O)C[C@]2(O)C(=O)c3cc(OC)cc(O)c3C(=O)[C@@]12O
InChIInChI=1S/C19H23NO8/c1-3-4-13-19(26)17(24)15-11(5-9(27-2)6-12(15)21)16(23)18(19,25)8-10(28-13)7-14(20)22/h5-6,10,13,21,25-26H,3-4,7-8H2,1-2H3,(H2,20,22)/t10-,13-,18+,19+/m1/s1
InChIKeyPEEHMYIBRREDFW-OLNJAIPVSA-N
Species of MetaboliteComponentSourceComments
Nonomuraea (ncbitaxon:83681) - PubMed (25046128)
ChEBI Ontology
Outgoing Relation(s)
Hypogeamicin C (CHEBI:205079) is a benzochromenone (CHEBI:64986)
Hypogeamicin C (CHEBI:205079) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[(1R,3S,4aR,10aR)-4a,9,10a-trihydroxy-7-methoxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetamide
Manual XrefsDatabases
58113341ChemSpider