EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:216318 - Pyrazolofluostatin C

ChEBI IDCHEBI:216318
ChEBI NamePyrazolofluostatin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H14N2O5
Net Charge0
Average Mass338.319
Monoisotopic Mass338.09027
SMILESC[C@H]1c2nnc3c(O)c4c(c(c23)[C@@H](O)[C@@H]1O)C(=O)c1cccc(O)c1-4
InChIInChI=1S/C18H14N2O5/c1-5-13-12-11(18(25)15(5)22)10-9(17(24)14(12)20-19-13)8-6(16(10)23)3-2-4-7(8)21/h2-5,15,18,21-22,24-25H,1H3,(H,19,20)/t5-,15+,18+/m0/s1
InChIKeyTUQCSNGUZSFMMS-XWHICQIGSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (28075605)
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
Pyrazolofluostatin C (CHEBI:216318) is a fluorenes (CHEBI:24059)
IUPAC Name 
(16S,17R,18R)-8,11,17,18-tetrahydroxy-16-methyl-13,14-diazapentacyclo[10.6.1.02,10.04,9.015,19]nonadeca-1,4(9),5,7,10,12,15(19)-heptaen-3-one
Manual XrefsDatabases
60958404ChemSpider