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(Q83060962)
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Isohyperoside
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavone
1 reference
based on heuristic
inferred from SMILES
mass
464.09547608
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
3-[(2S,3R,4S,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
isoquercitrin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₀O₁₂
0 references
canonical SMILES
O=C1C(OC2OC(C(O)CO)C(O)C2O)=C(OC=3C=C(O)C=C(O)C13)C=4C=CC(O)=C(O)C4
0 references
isomeric SMILES
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H](O4)[C@@H](CO)O)O)O)O)O
0 references
Identifiers
InChI
InChI=1S/C21H20O12/c22-6-12(27)19-16(29)17(30)21(32-19)33-20-15(28)14-11(26)4-8(23)5-13(14)31-18(20)7-1-2-9(24)10(25)3-7/h1-5,12,16-17,19,21-27,29-30H,6H2/t12-,16-,17-,19+,21+/m1/s1
0 references
InChIKey
OPJZLUXFQFQYAI-KHPGOBPMSA-N
0 references
CAS Registry Number
35589-21-0
0 references
PubChem CID
5748375
1 reference
matched by identifier from
InChIKey
InChIKey
OPJZLUXFQFQYAI-KHPGOBPMSA-N
UniChem compound ID
52825488
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70189053
1 reference
matched by identifier from
InChIKey
InChIKey
OPJZLUXFQFQYAI-KHPGOBPMSA-N
DSSTOX compound identifier
DTXCID00111544
0 references
Encyclopedia of China (Third Edition) ID
414174
0 references
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