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(Q105310301)
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English
Cadesin A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-c]xanthen-7-one
1 reference
based on heuristic
inferred from SMILES
mass
452.11073222
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₂₀O₉
0 references
canonical SMILES
O=C1C2=CC(OC)=C3OC(C4=CC=C(OC)C(O)=C4)C(OC3=C2OC=5C=CC=C(O)C15)CO
0 references
isomeric SMILES
COc1ccc([C@@H]2Oc3c(OC)cc4c(=O)c5c(O)cccc5oc4c3O[C@H]2CO)cc1O
0 references
found in taxon
Hypericum henryi
1 reference
stated in
Xanthones from Hypericum japonicum and H. henryi
Vismia baccifera
1 reference
stated in
Xanthones, xanthonolignoids and other constituents of the roots of vismia guaramirangae
Identifiers
InChI
InChI=1S/C24H20O9/c1-29-15-7-6-11(8-14(15)27)21-18(10-25)32-24-22-12(9-17(30-2)23(24)33-21)20(28)19-13(26)4-3-5-16(19)31-22/h3-9,18,21,25-27H,10H2,1-2H3/t18-,21-/m0/s1
0 references
InChIKey
WQAYAASFEHKNCW-RXVVDRJESA-N
0 references
PubChem CID
101288383
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
WQAYAASFEHKNCW-RXVVDRJESA-N
UniChem compound ID
96784173
1 reference
stated in
UniChem
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