EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:69989 - Mammea B/BB, (-)-

ChEBI IDCHEBI:69989
ChEBI NameMammea B/BB, (-)-
Stars
DefinitionA natural product found in Mammea americana.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H28O5
Net Charge0
Average Mass372.461
Monoisotopic Mass372.19367
SMILESCCCc1cc(=O)oc2c(C(=O)[C@@H](C)CC)c(O)c(CC=C(C)C)c(O)c12
InChIInChI=1S/C22H28O5/c1-6-8-14-11-16(23)27-22-17(14)20(25)15(10-9-12(3)4)21(26)18(22)19(24)13(5)7-2/h9,11,13,25-26H,6-8,10H2,1-5H3/t13-/m0/s1
InChIKeyFSOGIJPGPZWNGO-ZDUSSCGKSA-N
Species of MetaboliteComponentSourceComments
Mammea americana (ncbitaxon:198777) stem (BTO:0001300) PubMed (21214226) Previous component: stem bark; Dichloromethane/Methanol (1:1) extract of dried stem bark
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Mammea B/BB, (-)- (CHEBI:69989) has role metabolite (CHEBI:25212)
Mammea B/BB, (-)- (CHEBI:69989) is a hydroxycoumarin (CHEBI:37912)
Synonym  Source
(-)-5,7-Dihydroxy-8-[(2S)-2-methylbutanoyl]-6-(3-methyl-2-buten-1-yl)-4-propyl-2H-chromen-2-oneChEBI
Citations