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(Q67879922)
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English
humuladienone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
humulane-type sesquiterpenoid
0 references
mass
220.182715388
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₄O
0 references
canonical SMILES
O=C1CCC(=CCC(C=CCC1C)(C)C)C
0 references
isomeric SMILES
CC1C/C=C\C(C/C=C(\CCC1=O)/C)(C)C
0 references
found in taxon
Helichrysum odoratissimum
1 reference
stated in
The Chemical Composition of the Essential Leaf Oil ofHelichrysum odoratissimumSweet from Zimbabwe
Orthosiphon grandiflorus
1 reference
stated in
Content and Composition of the Essential Oil ofOrthosiphon aristatus
Orthosiphon aristatus
1 reference
stated in
Content and Composition of the Essential Oil ofOrthosiphon aristatus
Identifiers
InChI
InChI=1S/C15H24O/c1-12-7-8-14(16)13(2)6-5-10-15(3,4)11-9-12/h5,9-10,13H,6-8,11H2,1-4H3/b10-5-,12-9-
0 references
InChIKey
XWFINABYEHNSEP-CGBKSYCJSA-N
0 references
PubChem CID
101297706
0 references
UniChem compound ID
31997747
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0038208
1 reference
based on heuristic
inferred from InChIKey
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