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English
Scolochinenoside B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[6-(4-Acetylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxybenzoate
1 reference
based on heuristic
inferred from SMILES
mass
418.126382284
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₂O₉
0 references
canonical SMILES
O=C(OCC1OC(OC2=CC=C(C=C2)C(=O)C)C(O)C(O)C1O)C3=CC=C(O)C=C3
0 references
isomeric SMILES
CC(=O)c1ccc(O[C@@H]2O[C@H](COC(=O)c3ccc(O)cc3)[C@@H](O)[C@H](O)[C@H]2O)cc1
0 references
found in taxon
Scolopia chinensis
1 reference
stated in
Constituents from Leaves ofScolopia chinensis
Identifiers
InChI
InChI=1S/C21H22O9/c1-11(22)12-4-8-15(9-5-12)29-21-19(26)18(25)17(24)16(30-21)10-28-20(27)13-2-6-14(23)7-3-13/h2-9,16-19,21,23-26H,10H2,1H3/t16-,17-,18+,19-,21-/m1/s1
0 references
InChIKey
HCJAUKQCYUHSKC-GQUPQBGVSA-N
0 references
PubChem CID
101861836
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HCJAUKQCYUHSKC-GQUPQBGVSA-N
UniChem compound ID
97650680
1 reference
stated in
UniChem
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