EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:174937 - Antibiotic SB 202742

ChEBI IDCHEBI:174937
ChEBI NameAntibiotic SB 202742
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H34O3
Net Charge0
Average Mass370.533
Monoisotopic Mass370.25079
SMILESCC/C=C\C/C=C/C/C=C/CCCCCCCc1cccc(O)c1C(=O)O
InChIInChI=1S/C24H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h3-4,6-7,9-10,17,19-20,25H,2,5,8,11-16,18H2,1H3,(H,26,27)/b4-3-,7-6+,10-9+
InChIKeyMBYMHCHZLAJVRK-YSFKBSJESA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Antibiotic SB 202742 (CHEBI:174937) has functional parent salicylic acid (CHEBI:16914)
Antibiotic SB 202742 (CHEBI:174937) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
2-[(8E,11E,14Z)-heptadeca-8,11,14-trienyl]-6-hydroxybenzoic acid
Manual XrefsDatabases
HMDB0041206HMDB
30777541ChemSpider