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CHEBI:144131 - 22-Hydroxy-1-hopanone

ChEBI IDCHEBI:144131
ChEBI Name22-Hydroxy-1-hopanone
Stars
Submittermwilliams
DownloadsMolfile
FormulaC30H50O2
Net Charge0
Average Mass442.728
Monoisotopic Mass442.38108
SMILESCC1(C)CCC(=O)[C@@]2(C)C1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CC[C@H](C(C)(C)O)[C@@H]3CC[C@]21C
InChIInChI=1S/C30H50O2/c1-25(2)15-14-24(31)30(8)21(25)13-18-29(7)23(30)10-9-22-27(5)16-11-19(26(3,4)32)20(27)12-17-28(22,29)6/h19-23,32H,9-18H2,1-8H3/t19-,20-,21?,22+,23-,27-,28+,29+,30-/m0/s1
InChIKeyOFMYBLNHEMHCAO-LISTXKHRSA-N
ChEBI Ontology
Outgoing Relation(s)
22-Hydroxy-1-hopanone (CHEBI:144131) is a hopanoid (CHEBI:51963)