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CHEBI:185104 - Lagerstroemine

ChEBI IDCHEBI:185104
ChEBI NameLagerstroemine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H31NO5
Net Charge0
Average Mass437.536
Monoisotopic Mass437.22022
SMILESCOc1ccc2c(c1OC)-c1cc(ccc1O)CCC(=O)OC1CC3CCCCN3C2C1
InChIInChI=1S/C26H31NO5/c1-30-23-10-8-19-21-15-18(14-17-5-3-4-12-27(17)21)32-24(29)11-7-16-6-9-22(28)20(13-16)25(19)26(23)31-2/h6,8-10,13,17-18,21,28H,3-5,7,11-12,14-15H2,1-2H3
InChIKeyRYMSMTOEKVDTDB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
Lagerstroemine (CHEBI:185104) is a macrolide (CHEBI:25106)
IUPAC Name 
9-hydroxy-5,6-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2(7),3,5,8,10,12(26)-hexaen-15-one
Manual XrefsDatabases
35013165ChemSpider
HMDB0030229HMDB