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(Q105309167)
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English
(3S,7R)-5,6-dehydro-de-O-methyl-centrolobine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(3S,7S)-5,6-dehydro-4''-de-O-methylcentrolobine
1 reference
based on heuristic
inferred from SMILES
mass
296.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₀O₃
0 references
canonical SMILES
OC1=CC=C(C=C1)CCC2OC(C=CC2)C3=CC=C(O)C=C3
0 references
isomeric SMILES
Oc1ccc(CC[C@H]2CC=C[C@H](c3ccc(O)cc3)O2)cc1
0 references
found in taxon
Alpinia blepharocalyx
1 reference
stated in
New diarylheptanoid from the seeds of Alpinia blepharocalyx
Alpinia roxburghii
1 reference
stated in
New diarylheptanoid from the seeds of Alpinia blepharocalyx
Identifiers
InChI
InChI=1S/C19H20O3/c20-16-9-4-14(5-10-16)6-13-18-2-1-3-19(22-18)15-7-11-17(21)12-8-15/h1,3-5,7-12,18-21H,2,6,13H2/t18-,19-/m1/s1
0 references
InChIKey
WNMSDVNIAXMQRI-RTBURBONSA-N
0 references
PubChem CID
10780267
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WNMSDVNIAXMQRI-RTBURBONSA-N
UniChem compound ID
463542
1 reference
stated in
UniChem
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