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CHEBI:192028 - Physalin P

ChEBI IDCHEBI:192028
ChEBI NamePhysalin P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H30O10
Net Charge0
Average Mass526.538
Monoisotopic Mass526.18390
SMILESCC12CC3OC(=O)C1COC14C(=O)OC5(C(CCC6C1(O)C=CC1(O)CC=CC(=O)C61C)C(=O)OC35C)C24
InChIInChI=1S/C28H30O10/c1-22-11-17-24(3)27-13(19(31)37-24)6-7-15-23(2)16(29)5-4-8-25(23,33)9-10-26(15,34)28(20(22)27,21(32)38-27)35-12-14(22)18(30)36-17/h4-5,9-10,13-15,17,20,33-34H,6-8,11-12H2,1-3H3
InChIKeyWKKNNSSKEXVLKY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
Physalin P (CHEBI:192028) is a physalin (CHEBI:76361)
IUPAC Name 
14,17-dihydroxy-2,9,26-trimethyl-3,19,23,28-tetraoxaoctacyclo[16.9.2.01,5.02,24.08,17.09,14.018,27.021,26]nonacosa-11,15-diene-4,10,22,29-tetrone
Manual XrefsDatabases
35014843ChemSpider
HMDB0039639HMDB