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CHEBI:185634 - Gangetinin

Default Structure
ChEBI IDCHEBI:185634
ChEBI NameGangetinin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H26O5
Net Charge0
Average Mass418.489
Monoisotopic Mass418.17802
SMILESCOc1c2c(cc3c1C1Oc4c(ccc5c4C=CC(C)(C)O5)C1CO3)OC(C)(C)C=C2
InChIInChI=1S/C26H26O5/c1-25(2)10-8-15-18(30-25)7-6-14-17-13-28-20-12-19-16(9-11-26(3,4)31-19)23(27-5)21(20)24(17)29-22(14)15/h6-12,17,24H,13H2,1-5H3
InChIKeyGYTBWEWXRFODTH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Gangetinin (CHEBI:185634) is a pterocarpans (CHEBI:26377)
IUPAC Name 
3-methoxy-7,7,20,20-tetramethyl-8,12,19,25-tetraoxahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosa-2(11),3,5,9,15(24),16,18(23),21-octaene
Manual XrefsDatabases
24843031ChemSpider
LMPK12070098LIPID MAPS