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CHEBI:68754 - 20-dihydrochaetoglobosin A

Default Structure
ChEBI IDCHEBI:68754
ChEBI Name20-dihydrochaetoglobosin A
Stars
DefinitionA natural product found in Chaetomium subaffine.( Compound class : cytochalasan alkaloid)
DownloadsMolfile
FormulaC32H46N2O5
Net Charge0
Average Mass538.729
Monoisotopic Mass538.34067
SMILES[H]O[C@@]1([H])/C([H])=C(\[H])C(=O)[C@@]23C(=O)N([H])[C@@]([H])(C([H])([H])C4C5C([H])C([H])C([H])C([H])C5N([H])C4[H])[C@]2([H])[C@]([H])(C([H])([H])[H])[C@@]2(C([H])([H])[H])O[C@@]2([H])C3([H])/C([H])=C(\[H])C([H])([H])[C@]([H])(C([H])([H])[H])/C([H])=C(\C([H])([H])[H])[C@@]1([H])O[H]
InChIInChI=1S/C32H46N2O5/c1-17-8-7-10-22-29-31(4,39-29)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(38)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h7,10,12-14,17,19-25,27-29,33,35,37H,5-6,8-9,11,15-16H2,1-4H3,(H,34,38)/b10-7+,13-12+,18-14+/t17-,19-,20?,21?,22?,23?,24-,25-,27-,28+,29-,31+,32+/m0/s1
InChIKeyRXJAKJKZQTXAFX-HFRKVNEHSA-N
Species of MetaboliteComponentSourceComments
Chaetomium subaffine (ncbitaxon:1036253) - CiteXplore (c6155)
ChEBI Ontology
Outgoing Relation(s)
20-dihydrochaetoglobosin A (CHEBI:68754) has role metabolite (CHEBI:25212)
20-dihydrochaetoglobosin A (CHEBI:68754) is a organic molecular entity (CHEBI:50860)
Citations