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(Q105387152)
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English
2-[(1E,3R,4S)-3,4-Dihydroxy-1-pentenyl]-6-hydroxybenzaldehyde
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-(3,4-Dihydroxypent-1-enyl)-6-hydroxybenzaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
222.089208928
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Agropyrenol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₄O₄
0 references
canonical SMILES
O=CC=1C(O)=CC=CC1C=CC(O)C(O)C
0 references
isomeric SMILES
C[C@H](O)[C@H](O)/C=C/c1cccc(O)c1C=O
0 references
found in taxon
Sordaria macrospora
1 reference
stated in
New Hexaketides Related to Sordariol in Sordaria macrospora
Neurospora heterospora
1 reference
stated in
Immunomodulatory constituents from three ascomycetes, Gelasinospora heterospora, G. multiforis, and G. longispora
Neurospora longispora
1 reference
stated in
Immunomodulatory constituents from three ascomycetes, Gelasinospora heterospora, G. multiforis, and G. longispora
Neurospora santi-florii
1 reference
stated in
Nine Constituents Including Six Xanthone-Related Compounds Isolated from Two Ascomycetes, Gelasinospora santi-florii and Emericella quadrilineata, Found in a Screening Study Focused on Immunomodulatory Activity
Identifiers
InChI
InChI=1S/C12H14O4/c1-8(14)11(15)6-5-9-3-2-4-12(16)10(9)7-13/h2-8,11,14-16H,1H3/b6-5+/t8-,11+/m0/s1
0 references
InChIKey
ZZWHWGZFHPVYFV-PHTUBKJSSA-N
0 references
PubChem CID
10489200
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZZWHWGZFHPVYFV-PHTUBKJSSA-N
ChEBI ID
221026
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H14O4/c1-8(14)11(15)6-5-9-3-2-4-12(16)10(9)7-13/h2-8,11,14-16H,1H3/b6-5+/t8-,11+/m0/s1
UniChem compound ID
32116961
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA033030
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZZWHWGZFHPVYFV-PHTUBKJSSA-N
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