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CHEBI:4648 - hop-22(29)-ene

ChEBI IDCHEBI:4648
ChEBI Namehop-22(29)-ene
Stars
DefinitionA triterpene consisting of hopane having a C=C double bond at the 22(29)-position.
Last Modified8 November 2016
DownloadsMolfile
FormulaC30H50
Net Charge0
Average Mass410.730
Monoisotopic Mass410.39125
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)CC[C@]21C
InChIInChI=1S/C30H50/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1
InChIKeyHHXYJYBYNZMZKX-PYQRSULMSA-N
ChEBI Ontology
Outgoing Relation(s)
hop-22(29)-ene (CHEBI:4648) has parent hydride hopane (CHEBI:36482)
hop-22(29)-ene (CHEBI:4648) is a triterpene (CHEBI:35191)
Incoming Relation(s)
2β-methylhop-22(29)-ene (CHEBI:132460) has functional parent hop-22(29)-ene (CHEBI:4648)
IUPAC Name 
hop-22(29)-ene
Synonyms  Source
22(29)-HopeneKEGG COMPOUND
A'-neogammacer-22(29)-eneChemIDplus
DiplopteneKEGG COMPOUND
Hop-22(29)-eneKEGG COMPOUND
UniProt Name  Source
hop-22(29)-eneUniProt
Manual XrefsDatabases
C06310KEGG COMPOUND
Registry NumbersSources
Reaxys:2419865Reaxys
CAS:1615-91-4KEGG COMPOUND
CAS:1615-91-4ChemIDplus
Citations