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(Q110172401)
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English
2-O-methylbutyrolactone II
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
370.105252916
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₈O₇
0 references
canonical SMILES
O=C1OC(C(=O)OC)(C(C=2C=CC(O)=CC2)=C1OC)CC3=CC=C(O)C=C3
0 references
isomeric SMILES
COC(=O)[C@]1(Cc2ccc(O)cc2)OC(=O)C(OC)=C1c1ccc(O)cc1
0 references
found in taxon
Aspergillus
2 references
stated in
Bioactive steroid derivatives and butyrolactone derivatives from a gorgonian-derived Aspergillus sp. fungus
stated in
Metabolites from the Plant Endophytic Fungus Aspergillus sp. CPCC 400735 and Their Anti-HIV Activities.
Identifiers
InChI
InChI=1S/C20H18O7/c1-25-17-16(13-5-9-15(22)10-6-13)20(19(24)26-2,27-18(17)23)11-12-3-7-14(21)8-4-12/h3-10,21-22H,11H2,1-2H3/t20-/m1/s1
0 references
InChIKey
DYMYDSWEIIXYNX-HXUWFJFHSA-N
0 references
PubChem CID
38348485
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DYMYDSWEIIXYNX-HXUWFJFHSA-N
ChEBI ID
217757
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H18O7/c1-25-17-16(13-5-9-15(22)10-6-13)20(19(24)26-2,27-18(17)23)11-12-3-7-14(21)8-4-12/h3-10,21-22H,11H2,1-2H3/t20-/m1/s1
UniChem compound ID
1195589
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA032342
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DYMYDSWEIIXYNX-HXUWFJFHSA-N
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