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(Q82928499)
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English
ludovicin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Ridentin B
1 reference
based on heuristic
inferred from SMILES
mass
264.13615912
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aR,5aR,6R,8R,9aS,9bS)-6,8-dihydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aR,5aR,6S,8R,9aS,9bS)-6,8-dihydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aS,5aR,6R,8S,9aS,9bS)-6,8-dihydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one
1 reference
based on heuristic
inferred from InChI
Cxfaeusgwyviju-xfkurjonsa-
1 reference
based on heuristic
inferred from InChI
(3aS,5aR,6S,8R,9aR,9bS)-6,8-dihydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₄
0 references
canonical SMILES
O=C1OC2C(C1=C)CCC3(C)C(O)CC(O)C(=C)C23
0 references
isomeric SMILES
C=C1C(=O)O[C@H]2[C@H]1CC[C@@]1(C)[C@@H](O)C[C@@H](O)C(=C)[C@H]21
0 references
found in taxon
Artemisia mongolica
1 reference
stated in
New eudesmane sesquiterpene and other constituents from Artemisia mongolica
Artemisia ludoviciana
1 reference
stated in
Sesquiterpene lactones of artemisia constituents of A. ludoviciana SSP. mexicana
Tanacetum praeteritum
2 references
stated in
Sesquiterpene lactones from Tanacetum praeteritum
stated in
Cytotoxic and antibacterial activities of sesquiterpene lactones isolated from Tanacetum praeteritum subsp. praeteritum
Identifiers
InChI
InChI=1S/C15H20O4/c1-7-9-4-5-15(3)11(17)6-10(16)8(2)12(15)13(9)19-14(7)18/h9-13,16-17H,1-2,4-6H2,3H3/t9-,10+,11-,12+,13-,15-/m0/s1
0 references
InChIKey
CXFAEUSGWYVIJU-VPLWTHEFSA-N
0 references
CAS Registry Number
27740-14-3
0 references
PubChem CID
168723
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CXFAEUSGWYVIJU-VPLWTHEFSA-N
UniChem compound ID
446690
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20950437
1 reference
matched by identifier from
InChIKey
InChIKey
CXFAEUSGWYVIJU-VPLWTHEFSA-N
DSSTOX compound identifier
DTXCID101378596
0 references
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