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CHEBI:36484 - hopan-22-ol

ChEBI IDCHEBI:36484
ChEBI Namehopan-22-ol
Stars
DefinitionA hopanoid that is hopane substituted by a hydroxy group at position 22.
Secondary ChEBI IDsCHEBI:4649, CHEBI:14411
Last Modified8 November 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC30H52O
Net Charge0
Average Mass428.745
Monoisotopic Mass428.40182
SMILES[H][C@]12CC[C@@]3([H])[C@@](C)(CC[C@@]4([H])C(C)(C)CCC[C@]34C)[C@]1(C)CC[C@@]1([H])[C@@H](C(C)(C)O)CC[C@]21C
InChIInChI=1S/C30H52O/c1-25(2)15-9-16-28(6)22(25)14-19-30(8)24(28)11-10-23-27(5)17-12-20(26(3,4)31)21(27)13-18-29(23,30)7/h20-24,31H,9-19H2,1-8H3/t20-,21-,22-,23+,24+,27-,28-,29+,30+/m0/s1
InChIKeyPNJBOAVCVAVRGR-UDCAXGDQSA-N
Species of MetaboliteComponentSourceComments
Lepisorus contortus (ncbitaxon:699669) whole plant (BTO:0001461) PubMed (21261296) 95% EtOH extract of air-dried, powdered whole plant
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)
hopan-22-ol (CHEBI:36484) has role plant metabolite (CHEBI:76924)
hopan-22-ol (CHEBI:36484) is a hopanoid (CHEBI:51963)
hopan-22-ol (CHEBI:36484) is a pentacyclic triterpenoid (CHEBI:25872)
hopan-22-ol (CHEBI:36484) is a tertiary alcohol (CHEBI:26878)
Incoming Relation(s)
2β-methylhopan-22-ol (CHEBI:132462) has functional parent hopan-22-ol (CHEBI:36484)
IUPAC Name 
hopan-22-ol
Synonyms  Source
22-HopanolKEGG COMPOUND
22-hydroxyhopaneChemIDplus
29,29-dimethyl-21,30-dinorgammaceran-29-olIUPAC
A'-neogammaceran-22-olChemIDplus
DiplopterolKEGG COMPOUND
Hopan-22-olKEGG COMPOUND
UniProt Name  Source
hopan-22-olUniProt
Manual XrefsDatabases
C06309KEGG COMPOUND
LMPR04000002LIPID MAPS
Registry NumbersSources
Beilstein:2566100Beilstein
CAS:1721-59-1KEGG COMPOUND
CAS:1721-59-1ChemIDplus
Citations