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(Q77519935)
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English
Dehydrobotrydienal
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
1,3,3,6-tetramethyl-2H-indene-1,7-dicarbaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
230.130679816
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₈O₂
0 references
canonical SMILES
O=CC=1C(=CC=C2C1C(C=O)(C)CC2(C)C)C
0 references
isomeric SMILES
CC1=C(C2=C(C=C1)C(C[C@]2(C)C=O)(C)C)C=O
0 references
found in taxon
Botryotinia squamosa
3 references
stated in
Botrydienal, a new prytotoxin, and its related metabolites, dehydrobotrydienal and deacetyldihydrobotrydial produced by botryotinia squamosa
stated in
Botrydienal, a new prytotoxin, and its related metabolites, dehydrobotrydienal and deacetyldihydrobotrydial produced by botryotinia squamosa
stated in
Botrydienal, a new prytotoxin, and its related metabolites, dehydrobotrydienal and deacetyldihydrobotrydial produced by botryotinia squamosa
Identifiers
InChI
InChI=1S/C15H18O2/c1-10-5-6-12-13(11(10)7-16)15(4,9-17)8-14(12,2)3/h5-7,9H,8H2,1-4H3/t15-/m1/s1
0 references
InChIKey
TYEKKGOLTVUTJI-OAHLLOKOSA-N
2 references
stated in
PubChem
PubChem CID
10443849
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10443849
language of work or name
English
PubChem CID
10443849
2 references
stated in
PubChem
PubChem CID
10443849
language of work or name
English
matched by identifier from
InChIKey
InChIKey
TYEKKGOLTVUTJI-OAHLLOKOSA-N
ChEBI ID
210473
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H18O2/c1-10-5-6-12-13(11(10)7-16)15(4,9-17)8-14(12,2)3/h5-7,9H,8H2,1-4H3/t15-/m1/s1
UniChem compound ID
37541
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA014170
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
TYEKKGOLTVUTJI-OAHLLOKOSA-N
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