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English
Pterosin J
group of stereoisomers with the chemical formula C₁₄H₁₇ClO₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
252.091707464
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₇ClO₂
0 references
canonical SMILES
O=C1C2=C(C(=C(C=C2C(O)C1C)C)CCCl)C
0 references
found in taxon
Pteris tremula
1 reference
stated in
Chemical and Chemotaxonomical Studies on Filices. LV. Studies on the Constituents of Several Species of Pteris
Pteridium aquilinum
1 reference
stated in
Chemical and toxicological studies on bracken fern, Pteridium aquilinum var. latiusculum. I. Introduction, extraction and fractionation of constituents, and toxicological studies including carcinogenicity tests
Identifiers
InChI
InChI=1S/C14H17ClO2/c1-7-6-11-12(8(2)10(7)4-5-15)14(17)9(3)13(11)16/h6,9,13,16H,4-5H2,1-3H3
0 references
InChIKey
QKHXGZXWZRQICQ-UHFFFAOYSA-N
0 references
PubChem CID
5320786
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QKHXGZXWZRQICQ-UHFFFAOYSA-N
ChEBI ID
230635
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C14H17ClO2/c1-7-6-11-12(8(2)10(7)4-5-15)14(17)9(3)13(11)16/h6,9,13,16H,4-5H2,1-3H3
UniChem compound ID
32010159
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0038161
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QKHXGZXWZRQICQ-UHFFFAOYSA-N
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