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CHEBI:144130 - 22-Hydroxy-2-hopen-1-one

ChEBI IDCHEBI:144130
ChEBI Name22-Hydroxy-2-hopen-1-one
Stars
Submittermwilliams
DownloadsMolfile
FormulaC30H48O2
Net Charge0
Average Mass440.712
Monoisotopic Mass440.36543
SMILESCC1(C)C=CC(=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/C30H48O2/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/h14-15,19-23,32H,9-13,16-18H2,1-8H3/t19-,20-,21?,22+,23-,27-,28+,29+,30-/m0/s1
InChIKeyYLKHZBZGHNOEES-LISTXKHRSA-N
ChEBI Ontology
Outgoing Relation(s)
22-Hydroxy-2-hopen-1-one (CHEBI:144130) is a hopanoid (CHEBI:51963)