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CHEBI:132267 - triptonide

ChEBI IDCHEBI:132267
ChEBI Nametriptonide
Stars
DefinitionA diterpene triepoxide that is triptobenzene K in which the acylhydroquinone moiety has undergone oxidation to the corresponding triepoxyketone derivative. It has been isolated from the roots of Tripterygium wilfordii.
Last Modified16 August 2016
Submitterliuqingping
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILES[H][C@@]12C[C@@H]3O[C@@]34C(=O)[C@@]3(C(C)C)O[C@H]3[C@@H]3O[C@@]34[C@@]1(C)CCC1=C2COC1=O
InChIInChI=1S/C20H22O6/c1-8(2)18-13(25-18)14-20(26-14)17(3)5-4-9-10(7-23-15(9)21)11(17)6-12-19(20,24-12)16(18)22/h8,11-14H,4-7H2,1-3H3/t11-,12-,13-,14-,17-,18-,19+,20+/m0/s1
InChIKeySWOVVKGLGOOUKI-ZHGGVEMFSA-N
Species of MetaboliteComponentSourceComments
Tripterygium wilfordii (ncbitaxon:458696) root (BTO:0001188) Article (Chinese Chemical Letters, 2010, 21(5), 600-602)
Roles Classification
Biological Role:
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
Applications:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
ChEBI Ontology
Outgoing Relation(s)
triptonide (CHEBI:132267) has role anti-inflammatory agent (CHEBI:67079)
triptonide (CHEBI:132267) has role antineoplastic agent (CHEBI:35610)
triptonide (CHEBI:132267) has role immunosuppressive agent (CHEBI:35705)
triptonide (CHEBI:132267) is a butenolide (CHEBI:50523)
triptonide (CHEBI:132267) is a cyclic ketone (CHEBI:3992)
triptonide (CHEBI:132267) is a diterpene triepoxide (CHEBI:133018)
triptonide (CHEBI:132267) is a organic heteroheptacyclic compound (CHEBI:52157)
IUPAC Name 
(3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione
Synonym  Source
(−)-triptonideChEBI
Manual XrefsDatabases
65411PubChem Compound
Registry NumbersSources
Reaxys:5313008Reaxys
Citations