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(Q105347074)
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English
Brucein B
group of stereoisomers with the chemical formula C₂₃H₂₈O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
picrasane
1 reference
inferred from
picrasane
mass
480.163161716
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₈O₁₁
0 references
canonical SMILES
O=C(OC1C(=O)OC2CC3C(=C(O)C(=O)CC3(C)C4C(O)C(O)C5(OCC24C15)C(=O)OC)C)C
0 references
found in taxon
Brucea javanica
1 reference
stated in
Anti-tobacco mosaic virus (TMV) Quassinoids from Brucea javanica (L.) Merr
Identifiers
InChI
InChI=1S/C23H28O11/c1-8-10-5-12-22-7-32-23(20(30)31-4,17(22)15(19(29)34-12)33-9(2)24)18(28)14(27)16(22)21(10,3)6-11(25)13(8)26/h10,12,14-18,26-28H,5-7H2,1-4H3
0 references
InChIKey
YDWODLQEUPYKGJ-UHFFFAOYSA-N
0 references
PubChem CID
280689
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDWODLQEUPYKGJ-UHFFFAOYSA-N
UniChem compound ID
58489860
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90948402
1 reference
matched by identifier from
InChIKey
InChIKey
YDWODLQEUPYKGJ-UHFFFAOYSA-N
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