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CHEBI:142990 - cyclolaudenol

ChEBI IDCHEBI:142990
ChEBI Namecyclolaudenol
Stars
DefinitionA pentacyclic triterpenoid that is (24S)-methyl-9β,19-cyclolanost-25-ene which carries a hydroxy group at position 3β. It is isolated from several plant species inclduing Turraeanthus and Tillandsia.
Last Modified30 January 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC31H52O
Net Charge0
Average Mass440.756
Monoisotopic Mass440.40182
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)CC[C@H](C)C(=C)C
InChIInChI=1S/C31H52O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h21-26,32H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,26-,28+,29-,30+,31-/m0/s1
InChIKeyIXHACUTUTOCSJE-HWTFXIFRSA-N
Species of MetaboliteComponentSourceComments
Tillandsia fasciculata (ncbitaxon:220113) leaf (BTO:0000713) PubMed (11473433)
Turraeanthus africanus (ncbitaxon:1672009) seed (PO:0009010) PubMed (19688688)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
cyclolaudenol (CHEBI:142990) has parent hydride cycloartane (CHEBI:37778)
cyclolaudenol (CHEBI:142990) has role plant metabolite (CHEBI:76924)
cyclolaudenol (CHEBI:142990) is a 3β-hydroxy steroid (CHEBI:36836)
cyclolaudenol (CHEBI:142990) is a pentacyclic triterpenoid (CHEBI:25872)
IUPAC Name 
24(S)-methyl-9β,19-cyclolanost-25-en-3β-ol
Synonyms  Source
(24S)-24-methylcycloart-25-en-3β-olSUBMITTER
(3β,9β,24S)-24-methyl-9,19-cyclolanost-25-en-3-olIUPAC
UniProt Name  Source
cyclolaudenolUniProt
Manual XrefsDatabases
C00045816KNApSAcK
CPD-22096MetaCyc
FDB014700FooDB
HMDB0035911HMDB
Registry NumbersSources
CAS:511-61-5ChemIDplus
CAS:511-61-5KNApSAcK
Citations