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(Q105184445)
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English
3'-Deoxy-4-O-methylepisappanol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-[(4-Hydroxyphenyl)methyl]-4-methoxy-2,4-dihydrochromene-3,7-diol
1 reference
based on heuristic
inferred from SMILES
mass
302.115423676
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
3'-Deoxy-4-O-methylsappanol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₈O₅
0 references
canonical SMILES
OC1=CC=C(C=C1)CC2(O)COC3=CC(O)=CC=C3C2OC
0 references
isomeric SMILES
CO[C@@H]1c2ccc(O)cc2OC[C@]1(O)Cc1ccc(O)cc1
0 references
found in taxon
Biancaea sappan
2 references
stated in
A new 3-benzylchroman derivative from Sappan Lignum (Caesalpinia sappan).
stated in
Phenolic compounds from Caesalpinia sappan heartwood and their anti-inflammatory activity
Identifiers
InChI
InChI=1S/C17H18O5/c1-21-16-14-7-6-13(19)8-15(14)22-10-17(16,20)9-11-2-4-12(18)5-3-11/h2-8,16,18-20H,9-10H2,1H3/t16-,17-/m1/s1
0 references
InChIKey
NRDMATSOBGRQDO-IAGOWNOFSA-N
0 references
CAS Registry Number
1052714-12-1
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
71463283
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NRDMATSOBGRQDO-IAGOWNOFSA-N
UniChem compound ID
31990643
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001306176
1 reference
matched by identifier from
InChIKey
InChIKey
NRDMATSOBGRQDO-IAGOWNOFSA-N
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