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(Q77368965)
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English
Nodulisporin F
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
1-[2,6-dihydroxy-3-(5-hydroxy-2-methyl-3,4-dihydro-2H-chromen-4-yl)phenyl]butan-1-one
1 reference
based on heuristic
inferred from SMILES
mass
342.146723804
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1-[2,6-dihydroxy-3-[(2S,4S)-5-hydroxy-2-methyl-3,4-dihydro-2H-chromen-4-yl]phenyl]butan-1-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
1-[2,6-dihydroxy-3-[(2S,4R)-5-hydroxy-2-methyl-3,4-dihydro-2H-chromen-4-yl]phenyl]butan-1-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₂O₅
0 references
canonical SMILES
O=C(C=1C(O)=CC=C(C1O)C2C=3C(O)=CC=CC3OC(C)C2)CCC
0 references
isomeric SMILES
CCCC(=O)C1=C(C=CC(=C1O)[C@@H]2C[C@H](OC3=CC=CC(=C23)O)C)O
0 references
found in taxon
Nodulisporium
1 reference
stated in
New Naphthalene-Chroman Coupling Products from the Endophytic Fungus,Nodulisporium sp.fromErica arborea
Identifiers
InChI
InChI=1S/C20H22O5/c1-3-5-14(21)19-16(23)9-8-12(20(19)24)13-10-11(2)25-17-7-4-6-15(22)18(13)17/h4,6-9,11,13,22-24H,3,5,10H2,1-2H3/t11-,13+/m1/s1
0 references
InChIKey
IJAFYCQHLNAYDS-YPMHNXCESA-N
2 references
stated in
PubChem
PubChem CID
42605050
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
42605050
language of work or name
English
PubChem CID
42605050
2 references
stated in
PubChem
PubChem CID
42605050
language of work or name
English
matched by identifier from
InChIKey
InChIKey
IJAFYCQHLNAYDS-YPMHNXCESA-N
ChEBI ID
202069
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H22O5/c1-3-5-14(21)19-16(23)9-8-12(20(19)24)13-10-11(2)25-17-7-4-6-15(22)18(13)17/h4,6-9,11,13,22-24H,3,5,10H2,1-2H3/t11-,13+/m1/s1
UniChem compound ID
34467290
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA004815
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IJAFYCQHLNAYDS-YPMHNXCESA-N
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