EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:226631 - Formicamycin N

ChEBI IDCHEBI:226631
ChEBI NameFormicamycin N
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H27ClO8
Net Charge0
Average Mass538.980
Monoisotopic Mass538.13945
SMILESCOc1cc(C)c(-c2cc(OC)c(Cl)c3c2C(=O)[C@@]2(O)C(=O)c4c(O)cc(O)cc4C(C)(C)[C@H]2C3)c(O)c1
InChIInChI=1S/C29H27ClO8/c1-12-6-14(37-4)9-19(33)22(12)15-10-20(38-5)25(30)16-11-21-28(2,3)17-7-13(31)8-18(32)24(17)27(35)29(21,36)26(34)23(15)16/h6-10,21,31-33,36H,11H2,1-5H3/t21-,29-/m1/s1
InChIKeyGYMKHISEUBVBBR-ONOMSOESSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32519857)
ChEBI Ontology
Outgoing Relation(s)
Formicamycin N (CHEBI:226631) is a tetralins (CHEBI:36786)
IUPAC Name 
(5aR,11aR)-10-chloro-2,4,5a-trihydroxy-7-(2-hydroxy-4-methoxy-6-methylphenyl)-9-methoxy-12,12-dimethyl-11,11a-dihydrotetracene-5,6-dione