EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:210462 - Strepoxepinmycin A

ChEBI IDCHEBI:210462
ChEBI NameStrepoxepinmycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H27NO9
Net Charge0
Average Mass473.478
Monoisotopic Mass473.16858
SMILESC[C@H]1O[C@@H]2CC(=O)O[C@@H]2c2oc(=O)c3ccc([C@H]4C[C@@H](N(C)C)[C@H](O)[C@@H](C)O4)c(O)c3c(=O)c21
InChIInChI=1S/C24H27NO9/c1-9-17-21(29)18-12(24(30)34-23(17)22-15(31-9)8-16(26)33-22)6-5-11(20(18)28)14-7-13(25(3)4)19(27)10(2)32-14/h5-6,9-10,13-15,19,22,27-28H,7-8H2,1-4H3/t9-,10-,13-,14-,15-,19-,22+/m1/s1
InChIKeyDOGTUFDIMWQYID-GFXYGLKWSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (30209946)
ChEBI Ontology
Outgoing Relation(s)
Strepoxepinmycin A (CHEBI:210462) is a phenols (CHEBI:33853)
IUPAC Name 
(12S,16R,18R)-5-[(2R,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-4-hydroxy-18-methyl-10,13,17-trioxatetracyclo[9.7.0.03,8.012,16]octadeca-1(11),3(8),4,6-tetraene-2,9,14-trione
Manual XrefsDatabases
71048391ChemSpider