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(Q104993124)
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English
Parakmerin A
group of stereoisomers with the chemical formula C₁₉H₂₀O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic benzofuran
1 reference
inferred from
biogenic benzofuran
mass
296.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₀O₃
0 references
canonical SMILES
OC1=CC=C(C=C1OC)C2OC3=CC=C(C=CC)C=C3C2C
0 references
isomeric SMILES
C/C=C/c1ccc2c(c1)C(C)C(c1ccc(O)c(OC)c1)O2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C19H20O3/c1-4-5-13-6-9-17-15(10-13)12(2)19(22-17)14-7-8-16(20)18(11-14)21-3/h4-12,19-20H,1-3H3/b5-4+
0 references
InChIKey
FCFVMNGCSPIORZ-SNAWJCMRSA-N
0 references
PubChem CID
14213226
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FCFVMNGCSPIORZ-SNAWJCMRSA-N
ChEBI ID
174823
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C19H20O3/c1-4-5-13-6-9-17-15(10-13)12(2)19(22-17)14-7-8-16(20)18(11-14)21-3/h4-12,19-20H,1-3H3/b5-4+
UniChem compound ID
31998962
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0033950
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FCFVMNGCSPIORZ-SNAWJCMRSA-N
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