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CHEBI:234083 - ursolic alehyde

ChEBI IDCHEBI:234083
ChEBI Nameursolic alehyde
Stars
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC30H48O2
Net Charge0
Average Mass440.712
Monoisotopic Mass440.36543
SMILES[H]C(=O)[C@]12CC[C@@H](C)[C@H](C)[C@@]1([H])C1=CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC2
InChIInChI=1S/C30H48O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,18-20,22-25,32H,9-17H2,1-7H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1
InChIKeyVLFUANNVMXKBPF-ZAPOICBTSA-N
ChEBI Ontology
Outgoing Relation(s)
ursolic alehyde (CHEBI:234083) is a hydroxyaldehyde (CHEBI:50413)
ursolic alehyde (CHEBI:234083) is a pentacyclic triterpenoid (CHEBI:25872)
UniProt Name  Source
ursolic alehydeUniProt
Manual XrefsDatabases
CPD-14495MetaCyc