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CHEBI:68753 - 19-O-acetylchaetoglobosin B

Default Structure
ChEBI IDCHEBI:68753
ChEBI Name19-O-acetylchaetoglobosin B
Stars
DefinitionA natural product found in Chaetomium globosum.( Compound class : cytochalasan alkaloid)
DownloadsMolfile
FormulaC34H46N2O6
Net Charge0
Average Mass578.750
Monoisotopic Mass578.33559
SMILES[H][C@@]12/C=C/C[C@H](C)/C=C(/C)[C@@H](OC(C)=O)C(=O)/C=C/C(=O)[C@]13C(=O)N[C@@H](CC1CNC4CCCCC14)[C@]3([H])C(C)=C(C)[C@H]2O
InChIInChI=1S/C34H46N2O6/c1-18-9-8-11-25-31(40)21(4)20(3)30-27(16-23-17-35-26-12-7-6-10-24(23)26)36-33(41)34(25,30)29(39)14-13-28(38)32(19(2)15-18)42-22(5)37/h8,11,13-15,18,23-27,30-32,35,40H,6-7,9-10,12,16-17H2,1-5H3,(H,36,41)/b11-8+,14-13+,19-15-/t18-,23?,24?,25-,26?,27-,30-,31+,32+,34+/m0/s1
InChIKeyKEASCBIRCSDTTJ-OYFMJGFWSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - CiteXplore (c6154)
ChEBI Ontology
Outgoing Relation(s)
19-O-acetylchaetoglobosin B (CHEBI:68753) has role metabolite (CHEBI:25212)
19-O-acetylchaetoglobosin B (CHEBI:68753) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
23314435ChemSpider
Citations