EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:142844 - 9β-9,19-cyclolanost-24-ene-3β,28-diol

Default Structure
ChEBI IDCHEBI:142844
ChEBI Name9β-9,19-cyclolanost-24-ene-3β,28-diol
Stars
ASCII Name9beta-9,19-cyclolanost-24-ene-3beta,28-diol
DefinitionA pentacyclic triterpenod that is 9β,19-cyclolanost-24-ene which is substituted by hydroxy groups at the 3β and 28 positions.
Last Modified15 November 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H50O2
Net Charge0
Average Mass442.728
Monoisotopic Mass442.38108
SMILES[H][C@@]12CC[C@]3([H])[C@@]4(CC[C@H](O)[C@@]3(C)CO)C[C@@]14CC[C@@]1(C)[C@@]2(C)CC[C@]1([H])[C@H](C)CCC=C(C)C
InChIInChI=1S/C30H50O2/c1-20(2)8-7-9-21(3)22-12-14-28(6)24-11-10-23-26(4,19-31)25(32)13-15-29(23)18-30(24,29)17-16-27(22,28)5/h8,21-25,31-32H,7,9-19H2,1-6H3/t21-,22-,23+,24+,25+,26+,27-,28+,29-,30+/m1/s1
InChIKeyUTTLWQMTEWKFNX-BPYUMQNDSA-N
ChEBI Ontology
Outgoing Relation(s)
9β-9,19-cyclolanost-24-ene-3β,28-diol (CHEBI:142844) has parent hydride lanostane (CHEBI:20265)
9β-9,19-cyclolanost-24-ene-3β,28-diol (CHEBI:142844) is a 3β-hydroxy-4α-hydroxymethyl-4β-methylsteroid (CHEBI:145351)
9β-9,19-cyclolanost-24-ene-3β,28-diol (CHEBI:142844) is a pentacyclic triterpenoid (CHEBI:25872)
9β-9,19-cyclolanost-24-ene-3β,28-diol (CHEBI:142844) is a phytosterols (CHEBI:26125)
Incoming Relation(s)
4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol (CHEBI:142845) has functional parent 9β-9,19-cyclolanost-24-ene-3β,28-diol (CHEBI:142844)
IUPAC Name 
9β-9,19-cyclolanost-24-ene-3β,28-diol
Synonym  Source
4α-hydroxymethyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-olChEBI
UniProt Name  Source
4α-hydroxymethyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-olUniProt
Citations