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CHEBI:202571 - Asiaticusin B

ChEBI IDCHEBI:202571
ChEBI NameAsiaticusin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O5
Net Charge0
Average Mass454.607
Monoisotopic Mass454.27192
SMILESC/C(=C/CCC(C)/C=C/CC(C)/C=C/CC(C)/C=C/Cc1cc(C(=O)O)ccc1O)C(=O)O
InChIInChI=1S/C28H38O5/c1-20(9-5-11-21(2)13-7-15-23(4)27(30)31)10-6-12-22(3)14-8-16-24-19-25(28(32)33)17-18-26(24)29/h5-6,8,10-11,14-15,17-22,29H,7,9,12-13,16H2,1-4H3,(H,30,31)(H,32,33)/b10-6+,11-5+,14-8+,23-15-
InChIKeyLPMYTILEFMOKDZ-SALQWAMYSA-N
Species of MetaboliteComponentSourceComments
Boletinus asiaticus (ncbitaxon:2725002) - DOI (10.1271/bbb.60.120)
ChEBI Ontology
Outgoing Relation(s)
Asiaticusin B (CHEBI:202571) is a diterpenoid (CHEBI:23849)
IUPAC Name 
3-[(2E,6E,10E,15Z)-16-carboxy-4,8,12-trimethylheptadeca-2,6,10,15-tetraenyl]-4-hydroxybenzoic acid
Manual XrefsDatabases
78444018ChemSpider