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(Q75057133)
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English
4,4'-dimethoxyvulpinic acid
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
tetronic acid
0 references
chemical structure
4,4′-dimethoxyvulpinic acid.svg
830 × 355; 18 KB
0 references
mass
382.105252916
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₁₈O₇
0 references
canonical SMILES
O=C1OC(C(O)=C1C=2C=CC(OC)=CC2)=C(C(=O)OC)C3=CC=C(OC)C=C3
0 references
isomeric SMILES
COC1=CC=C(C=C1)C2=C(/C(=C(/C3=CC=C(C=C3)OC)\C(=O)OC)/OC2=O)O
0 references
found in taxon
Scleroderma citrinum
1 reference
stated in
A bioactive triterpenoid and vulpinic acid derivatives from the mushroom Scleroderma citrinum
Identifiers
InChI
InChI=1S/C21H18O7/c1-25-14-8-4-12(5-9-14)16-18(22)19(28-21(16)24)17(20(23)27-3)13-6-10-15(26-2)11-7-13/h4-11,22H,1-3H3/b19-17+
0 references
InChIKey
VEJPFWDEGBXEMC-HTXNQAPBSA-N
0 references
PubChem CID
54718139
2 references
stated in
PubChem
PubChem CID
54718139
language of work or name
English
matched by identifier from
InChIKey
InChIKey
VEJPFWDEGBXEMC-HTXNQAPBSA-N
ChEBI ID
197931
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H18O7/c1-25-14-8-4-12(5-9-14)16-18(22)19(28-21(16)24)17(20(23)27-3)13-6-10-15(26-2)11-7-13/h4-11,22H,1-3H3/b19-17+
UniChem compound ID
61671
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA000453
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VEJPFWDEGBXEMC-HTXNQAPBSA-N
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