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CHEBI:69018 - physalin D

ChEBI IDCHEBI:69018
ChEBI Namephysalin D
Stars
DefinitionA physalin with antimalarial and antimycobacterial activities isolated from Physalis angulata.
Last Modified21 November 2013
DownloadsMolfile
FormulaC28H32O11
Net Charge0
Average Mass544.553
Monoisotopic Mass544.19446
SMILES[H][C@@]12C[C@@H](O)[C@@]3(O)CC=CC(=O)[C@]3(C)[C@@]1([H])CC[C@@]1(O)C(=O)O[C@]3(C)[C@]14O[C@]21OC[C@@]2([H])C(=O)O[C@]3([H])C[C@@]2(C)[C@]4([H])C1=O
InChIInChI=1S/C28H32O11/c1-22-10-17-24(3)28-18(22)19(31)27(39-28,36-11-14(22)20(32)37-17)13-9-16(30)25(34)7-4-5-15(29)23(25,2)12(13)6-8-26(28,35)21(33)38-24/h4-5,12-14,16-18,30,34-35H,6-11H2,1-3H3/t12-,13+,14-,16+,17+,18-,22+,23-,24-,25-,26+,27+,28-/m0/s1
InChIKeyDUGJJSWZRHBJJK-IFSNGKJOSA-N
Species of MetaboliteComponentSourceComments
Physalis angulata (ncbitaxon:113208) - PubMed (21954931)
Roles Classification
Biological Roles:
antimalarial  A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
antimycobacterial drug  A drug used to treat or prevent infections caused by Mycobacteria, a genus of actinobacteria. Aerobic and nonmotile, members of the genus include the pathogens responsible for causing tuberculosis and leprosy.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Applications:
antimalarial  A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
antimycobacterial drug  A drug used to treat or prevent infections caused by Mycobacteria, a genus of actinobacteria. Aerobic and nonmotile, members of the genus include the pathogens responsible for causing tuberculosis and leprosy.
ChEBI Ontology
Outgoing Relation(s)
physalin D (CHEBI:69018) has role antimalarial (CHEBI:38068)
physalin D (CHEBI:69018) has role antimycobacterial drug (CHEBI:64912)
physalin D (CHEBI:69018) has role antineoplastic agent (CHEBI:35610)
physalin D (CHEBI:69018) is a 5α-hydroxy steroid (CHEBI:38194)
physalin D (CHEBI:69018) is a 6β-hydroxy steroid (CHEBI:36851)
physalin D (CHEBI:69018) is a cyclic ether (CHEBI:37407)
physalin D (CHEBI:69018) is a enone (CHEBI:51689)
physalin D (CHEBI:69018) is a lactone (CHEBI:25000)
physalin D (CHEBI:69018) is a organic heteroheptacyclic compound (CHEBI:52157)
physalin D (CHEBI:69018) is a physalin (CHEBI:76361)
Synonym  Source
5α,6β-dihydroxy-5,6-dihydrophysalin BIUPAC
Manual XrefsDatabases
HMDB0034353HMDB
Registry NumbersSources
Reaxys:9107516Reaxys
Citations