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(Q105257333)
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Usenamine A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
10-acetyl-4-(1-aminoethylidene)-11,13-dihydroxy-2,12-dimethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),6,10,12-tetraene-3,5-dione
1 reference
based on heuristic
inferred from SMILES
mass
343.105587264
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₇NO₆
0 references
canonical SMILES
O=C1C=C2OC3=C(C(=O)C)C(O)=C(C(O)=C3C2(C(=O)C1=C(N)C)C)C
0 references
isomeric SMILES
CC(=O)c1c(O)c(C)c(O)c2c1OC1=CC(=O)/C(=C(/C)N)C(=O)[C@@]12C
0 references
found in taxon
Dolichousnea longissima
1 reference
stated in
Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima.
subject has role
cytotoxin
1 reference
stated in
Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima.
antifungal
1 reference
stated in
Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima.
Identifiers
InChI
InChI=1S/C18H17NO6/c1-6-14(22)12(8(3)20)16-13(15(6)23)18(4)10(25-16)5-9(21)11(7(2)19)17(18)24/h5,22-23H,19H2,1-4H3/b11-7+/t18-/m0/s1
0 references
InChIKey
SPBCRTZCVHEBTB-DBEXCURXSA-N
0 references
PubChem CID
71583068
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
227657
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H17NO6/c1-6-14(22)12(8(3)20)16-13(15(6)23)18(4)10(25-16)5-9(21)11(7(2)19)17(18)24/h5,22-23H,19H2,1-4H3/b11-7+/t18-/m0/s1
UniChem compound ID
32331176
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA021934
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SPBCRTZCVHEBTB-DBEXCURXSA-N
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