EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70622 - lippiolide

ChEBI IDCHEBI:70622
ChEBI Namelippiolide
Stars
DefinitionA natural product found in Lippia mexicana.
Last Modified22 September 2014
DownloadsMolfile
FormulaC30H46O4
Net Charge0
Average Mass470.694
Monoisotopic Mass470.33961
SMILES[H][C@]12CC[C@@]3([H])[C@@](C)(CC[C@@]4(C)CC(=O)O[C@@H](C(=C)C)[C@@]43[H])[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@]3(O)CC[C@]21CO3
InChIInChI=1S/C30H46O4/c1-18(2)24-23-19-8-9-21-28(7,27(19,6)13-12-26(23,5)16-22(31)34-24)11-10-20-25(3,4)30(32)15-14-29(20,21)17-33-30/h19-21,23-24,32H,1,8-17H2,2-7H3/t19-,20+,21+,23+,24+,26+,27-,28-,29-,30-/m1/s1
InChIKeyXVOHBMBYVJHVEX-PVXVMCPWSA-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)
lippiolide (CHEBI:70622) has role metabolite (CHEBI:25212)
lippiolide (CHEBI:70622) is a organic heterotricyclic compound (CHEBI:26979)
lippiolide (CHEBI:70622) is a organooxygen compound (CHEBI:36963)
Synonym  Source
3beta,25-epoxy-3alpha-hydroxy-19,21-seco-lup-20(29)-en-21,19-lactoneChEBI
Citations