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CHEBI:68806 - penochalasin A

Default Structure
ChEBI IDCHEBI:68806
ChEBI Namepenochalasin A
Stars
DefinitionA natural product found in Chaetomium globosum.( Compound class : cytochalasan alkaloid)
DownloadsMolfile
FormulaC33H47N3O4
Net Charge0
Average Mass549.756
Monoisotopic Mass549.35666
SMILES[H]/C1=C(\[H])[C@@]2([H])[C@]3([H])O[C@]3(C([H])([H])[H])[C@@]([H])(C([H])([H])[H])[C@]3([H])[C@]2(C(=O)N([H])[C@@]3([H])C([H])([H])C2C3C([H])C([H])C([H])C([H])C3N([H])C2[H])C2C([H])C([H])C(C(=O)C(=O)/C(C([H])([H])[H])=C(/[H])[C@@]([H])(C([H])([H])[H])C1([H])[H])N2[H]
InChIInChI=1S/C33H47N3O4/c1-17-8-7-10-22-30-32(4,40-30)19(3)27-25(15-20-16-34-23-11-6-5-9-21(20)23)36-31(39)33(22,27)26-13-12-24(35-26)29(38)28(37)18(2)14-17/h7,10,14,17,19-27,30,34-35H,5-6,8-9,11-13,15-16H2,1-4H3,(H,36,39)/b10-7-,18-14-/t17-,19-,20?,21?,22-,23?,24?,25-,26?,27-,30-,32+,33+/m0/s1
InChIKeyZVUUSCIUTSTAQU-VSECEXQQSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - PubMed (16499339)
ChEBI Ontology
Outgoing Relation(s)
penochalasin A (CHEBI:68806) has role metabolite (CHEBI:25212)
penochalasin A (CHEBI:68806) is a organic molecular entity (CHEBI:50860)
Citations