EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:215445 - 7-O-succinyl macrolactin F

ChEBI IDCHEBI:215445
ChEBI Name7-O-succinyl macrolactin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O8
Net Charge0
Average Mass502.604
Monoisotopic Mass502.25667
SMILESC[C@@H]1CCC/C=C/CCC(=O)C[C@@H](O)C/C=C\C=C\[C@@H](OC(=O)CCC(=O)O)C/C=C/C=C\C(=O)O1
InChIInChI=1S/C28H38O8/c1-22-13-7-3-2-4-8-14-23(29)21-24(30)15-9-5-10-16-25(36-28(34)20-19-26(31)32)17-11-6-12-18-27(33)35-22/h2,4-6,9-12,16,18,22,24-25,30H,3,7-8,13-15,17,19-21H2,1H3,(H,31,32)/b4-2+,9-5-,11-6+,16-10+,18-12-/t22-,24+,25-/m1/s1
InChIKeyQXSCSCFGEZMIKB-AELFMCOISA-N
Species of MetaboliteComponentSourceComments
Bacillus (ncbitaxon:1386) - PubMed (10924180)
ChEBI Ontology
Outgoing Relation(s)
7-O-succinyl macrolactin F (CHEBI:215445) is a macrolide (CHEBI:25106)
IUPAC Name 
4-[[(3Z,5E,8S,9E,11Z,14S,19E,24R)-14-hydroxy-24-methyl-2,16-dioxo-1-oxacyclotetracosa-3,5,9,11,19-pentaen-8-yl]oxy]-4-oxobutanoic acid
Manual XrefsDatabases
10242630ChemSpider