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(Q82103834)
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Humulinone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
378.20423868
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₀O₆
0 references
canonical SMILES
O=C(C=1C(=O)C(O)(C(=O)CC=C(C)C)C(O)(C1O)CC=C(C)C)CC(C)C
0 references
found in taxon
Humulus lupulus
5 references
stated in
Characterization of the methanolic extract of hops using capillary electrophoresis-electrospray ionization-mass spectrometry
stated in
Estrogens and congeners from spent hops (Humulus lupulus).
stated in
Estrogens and Congeners from Spent Hops (Humulus lupulus)
stated in
Metabolite profiling and fingerprinting of commercial cultivars of Humulus lupulus L. (hop): a comparison of MS and NMR methods in metabolomics
stated in
Chemical Characterization of Beer Aging Products Derived from Hard Resin Components in Hops (Humulus lupulus L.).
has characteristic
bitterness
1 reference
stated in
BitterDB
Identifiers
InChI
InChI=1S/C21H30O6/c1-12(2)7-8-16(23)21(27)19(25)17(15(22)11-14(5)6)18(24)20(21,26)10-9-13(3)4/h7,9,14,24,26-27H,8,10-11H2,1-6H3
0 references
InChIKey
KXBNQEYVZSCSNH-UHFFFAOYSA-N
0 references
CAS Registry Number
26110-47-4
0 references
PubChem CID
534962
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
ChEBI ID
175859
mapping relation type
exact match
1 reference
stated in
ChEBI release 2022-06-13
UniChem compound ID
49039495
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60336610
0 references
DSSTOX compound identifier
DTXCID20287699
0 references
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