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CHEBI:70625 - cycloart-23-ene-3beta,25-diol

ChEBI IDCHEBI:70625
ChEBI Namecycloart-23-ene-3beta,25-diol
Stars
DefinitionA natural product found in Lippia mexicana.
Last Modified22 September 2014
DownloadsMolfile
FormulaC30H50O2
Net Charge0
Average Mass442.728
Monoisotopic Mass442.38108
SMILES[H][C@@]12CC[C@@]3([H])C(C)(C)[C@@H](O)CC[C@@]34C[C@@]14CC[C@@]1(C)[C@@]2(C)CC[C@]1([H])[C@H](C)C/C=C/C(C)(C)O
InChIInChI=1S/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1
InChIKeyJSPGKOBNHWTKNT-CPGXJQKCSA-N
Species of MetaboliteComponentSourceComments
Lippia mexicana (IPNI:981940-1)
leaf (BTO:0000713) PubMed (20942442) Dried and ground leaves, flowers, and stems were extracted with Me2CO and then with MeOH
stem (BTO:0001300) PubMed (20942442) Dried and ground leaves, flowers, and stems were extracted with Me2CO and then with MeOH
flower (BTO:0000469) PubMed (20942442) Dried and ground leaves, flowers, and stems were extracted with Me2CO and then with MeOH
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)
cycloart-23-ene-3beta,25-diol (CHEBI:70625) has role metabolite (CHEBI:25212)
cycloart-23-ene-3beta,25-diol (CHEBI:70625) is a triterpenoid (CHEBI:36615)
Synonym  Source
(3beta,9beta,23E)-9,19-cyclolanost-23-ene-3,25-diolChEBI
Citations