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(Q105218111)
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English
(+)-1-Hydroxyboivinianic acid
chemical compound
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No label defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
236.068473484
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(-)-1-Hydroxyboivinianic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₂O₅
0 references
canonical SMILES
O=C(O)C1=CC=C(C(O)=C1)C2(OC(=O)CC2)C
0 references
isomeric SMILES
C[C@]1(c2ccc(C(=O)O)cc2O)CCC(=O)O1
0 references
found in taxon
Aspergillus versicolor
1 reference
stated in
3-Arylisoindolinone and sesquiterpene derivatives from the mangrove endophytic fungi Aspergillus versicolor SYSU-SKS025.
Identifiers
InChI
InChI=1S/C12H12O5/c1-12(5-4-10(14)17-12)8-3-2-7(11(15)16)6-9(8)13/h2-3,6,13H,4-5H2,1H3,(H,15,16)/t12-/m1/s1
0 references
InChIKey
QBZZGMOAQWNCHR-GFCCVEGCSA-N
0 references
PubChem CID
146684272
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QBZZGMOAQWNCHR-GFCCVEGCSA-N
ChEBI ID
217296
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H12O5/c1-12(5-4-10(14)17-12)8-3-2-7(11(15)16)6-9(8)13/h2-3,6,13H,4-5H2,1H3,(H,15,16)/t12-/m1/s1
UniChem compound ID
178087627
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA028073
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QBZZGMOAQWNCHR-GFCCVEGCSA-N
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