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(Q105193874)
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English
Bis(2-methylpropanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene
group of stereoisomers with the chemical formula C₁₈H₂₄O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
320.162373868
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₄O₅
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canonical SMILES
O=C(OC1=CC(=CC=C1C2(OC2)COC(=O)C(C)C)C)C(C)C
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found in taxon
Ageratina glechonophylla
1 reference
stated in
Chromenes and benzofurans from Ageratina glechonophylla
Inula japonica
1 reference
stated in
Sesquiterpenes and other constituents from the aerial parts of Inula japonica
Arnica montana
1 reference
stated in
High-Content Screening Pipeline for Natural Products Targeting Oncogenic Signaling in Melanoma
Pallenis hierochuntica
1 reference
stated in
Farnesol and Thymol Derivatives from Asteriscus, pygmaeus
Identifiers
InChI
InChI=1S/C18H24O5/c1-11(2)16(19)21-9-18(10-22-18)14-7-6-13(5)8-15(14)23-17(20)12(3)4/h6-8,11-12H,9-10H2,1-5H3
0 references
InChIKey
OLARKEMZPWGFJU-UHFFFAOYSA-N
0 references
CAS Registry Number
22518-06-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
11472669
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OLARKEMZPWGFJU-UHFFFAOYSA-N
ChEBI ID
168879
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H24O5/c1-11(2)16(19)21-9-18(10-22-18)14-7-6-13(5)8-15(14)23-17(20)12(3)4/h6-8,11-12H,9-10H2,1-5H3
UniChem compound ID
665814
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0032698
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OLARKEMZPWGFJU-UHFFFAOYSA-N
Probes And Drugs ID
PD125097
0 references
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