EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:205988 - Peyronetide C

ChEBI IDCHEBI:205988
ChEBI NamePeyronetide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26O7
Net Charge0
Average Mass426.465
Monoisotopic Mass426.16785
SMILESCC[C@H](C)/C=C(\C)c1cc2cc3c(c(O)c2c(=O)o1)C(=O)[C@](O)(CC(C)=O)C(OC)=C3
InChIInChI=1S/C24H26O7/c1-6-12(2)7-13(3)17-9-15-8-16-10-18(30-5)24(29,11-14(4)25)22(27)19(16)21(26)20(15)23(28)31-17/h7-10,12,26,29H,6,11H2,1-5H3/b13-7+/t12-,24-/m0/s1
InChIKeyBSAREYHEZFOODA-XUHHNZALSA-N
Species of MetaboliteComponentSourceComments
Didymella (ncbitaxon:55170) - PubMed (30621059)
ChEBI Ontology
Outgoing Relation(s)
Peyronetide C (CHEBI:205988) is a organic heterotricyclic compound (CHEBI:26979)
Peyronetide C (CHEBI:205988) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(8S)-8,10-dihydroxy-7-methoxy-3-[(E,4S)-4-methylhex-2-en-2-yl]-8-(2-oxopropyl)benzo[g]isochromene-1,9-dione