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CHEBI:144106 - 12-Desoxydiacetylpyxinol

ChEBI IDCHEBI:144106
ChEBI Name12-Desoxydiacetylpyxinol
Stars
Submittermwilliams
DownloadsMolfile
FormulaC34H56O5
Net Charge0
Average Mass544.817
Monoisotopic Mass544.41277
SMILESCC(=O)OC1CCC2(C)C(CCC3(C)C2CCC2C([C@@]4(C)CC[C@H](C(C)(C)OC(C)=O)O4)CC[C@]23C)C1(C)C
InChIInChI=1S/C34H56O5/c1-21(35)37-27-15-17-31(7)25(29(27,3)4)14-19-33(9)26(31)12-11-23-24(13-18-32(23,33)8)34(10)20-16-28(39-34)30(5,6)38-22(2)36/h23-28H,11-20H2,1-10H3/t23?,24?,25?,26?,27?,28-,31?,32-,33?,34-/m1/s1
InChIKeyRBQLECJYZFCFKA-OBVPLGEMSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
12-Desoxydiacetylpyxinol (CHEBI:144106) is a triterpenoid saponin (CHEBI:61778)