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(Q105137434)
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English
(2S)-3',4'-Dihydroxy-6,7-dimethoxyflavan
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavan
0 references
mass
302.11542367600003
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₇H₁₈O₅
0 references
canonical SMILES
OC1=CC=C(C=C1O)C2OC3=CC(OC)=C(OC)C=C3CC2
0 references
isomeric SMILES
COc1cc2c(cc1OC)O[C@H](c1ccc(O)c(O)c1)CC2
0 references
Identifiers
InChI
InChI=1S/C17H18O5/c1-20-16-8-11-4-6-14(22-15(11)9-17(16)21-2)10-3-5-12(18)13(19)7-10/h3,5,7-9,14,18-19H,4,6H2,1-2H3/t14-/m0/s1
0 references
InChIKey
JZJXKCZMGGESMI-AWEZNQCLSA-N
0 references
PubChem CID
71746434
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JZJXKCZMGGESMI-AWEZNQCLSA-N
UniChem compound ID
69477355
1 reference
stated in
UniChem
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