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(Q105130871)
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English
(2S)-4'-Hydroxy-6,7,3'-trimethoxyflavan
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavan
0 references
mass
316.13107374
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₈H₂₀O₅
0 references
canonical SMILES
OC1=CC=C(C=C1OC)C2OC3=CC(OC)=C(OC)C=C3CC2
0 references
isomeric SMILES
COc1cc([C@@H]2CCc3cc(OC)c(OC)cc3O2)ccc1O
0 references
Identifiers
InChI
InChI=1S/C18H20O5/c1-20-16-8-11(4-6-13(16)19)14-7-5-12-9-17(21-2)18(22-3)10-15(12)23-14/h4,6,8-10,14,19H,5,7H2,1-3H3/t14-/m0/s1
0 references
InChIKey
JLLHPTPUDAXLAG-AWEZNQCLSA-N
0 references
PubChem CID
71746243
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JLLHPTPUDAXLAG-AWEZNQCLSA-N
UniChem compound ID
69477353
1 reference
stated in
UniChem
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