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CHEBI:66261 - trichodimerol

ChEBI IDCHEBI:66261
ChEBI Nametrichodimerol
Stars
DefinitionAn organic heterotetracyclic compound found in Trichoderma longibrachiatum and Penicillium chrysogenum.
Last Modified13 January 2014
DownloadsMolfile
FormulaC28H32O8
Net Charge0
Average Mass496.556
Monoisotopic Mass496.20972
SMILES[H][C@]12C(C(=O)/C=C/C=C/C)=C(O)[C@]3(C)[C@@]4(O)O[C@]5(C)[C@](O)(O[C@]41C)[C@@]2(C)C(O)=C(C(=O)/C=C/C=C/C)[C@@]53[H]
InChIInChI=1S/C28H32O8/c1-7-9-11-13-15(29)17-19-23(3)22(32)18(16(30)14-12-10-8-2)20-24(4,21(17)31)28(34)25(19,5)35-27(23,33)26(20,6)36-28/h7-14,19-20,31-34H,1-6H3/b9-7+,10-8+,13-11+,14-12+/t19-,20-,23-,24-,25+,26+,27-,28-/m1/s1
InChIKeyVATYWOIGKMMCMM-OXGNLDDNSA-N
Species of MetaboliteComponentSourceComments
Trichoderma longibrachiatum (ncbitaxon:5548) - Article (CAN J CHEM, 1992, 70, 10, 2526)
Penicillium chrysogenum (ncbitaxon:5076) - PubMed (8626236) Strain: V 39673
Roles Classification
Biological Role:
Penicillium metabolite  Any fungal metabolite produced during a metabolic reaction in Penicillium.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
trichodimerol (CHEBI:66261) has role Penicillium metabolite (CHEBI:76964)
trichodimerol (CHEBI:66261) has role antineoplastic agent (CHEBI:35610)
trichodimerol (CHEBI:66261) is a cyclic ether (CHEBI:37407)
trichodimerol (CHEBI:66261) is a enone (CHEBI:51689)
trichodimerol (CHEBI:66261) is a organic heterotetracyclic compound (CHEBI:38163)
Synonym  Source
BMS-182123ChEBI
Registry NumbersSources
Reaxys:7609100Reaxys
Citations