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(Q82873480)
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(+)-Chamaechromone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
dihydrochalcones
1 reference
based on heuristic
inferred from SMILES
mass
542.1212969039999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
3-[(2R)-1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxychromen-4-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₂₂O₁₀
0 references
canonical SMILES
O=C(c1c(O)cc(O)cc1O)C(c1coc2cc(O)cc(O)c2c1=O)C(c1ccc(O)cc1)c1ccc(O)cc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)O)[C@@H](C3=COC4=CC(=CC(=C4C3=O)O)O)C(=O)C5=C(C=C(C=C5O)O)O)O
0 references
Identifiers
InChI
InChI=1S/C30H22O10/c31-16-5-1-14(2-6-16)25(15-3-7-17(32)8-4-15)26(30(39)27-21(35)9-18(33)10-22(27)36)20-13-40-24-12-19(34)11-23(37)28(24)29(20)38/h1-13,25-26,31-37H/t26-/m1/s1
0 references
InChIKey
KLKLIUIRQAMTAJ-AREMUKBSSA-N
0 references
CAS Registry Number
93413-00-4
0 references
PubChem CID
95790394
1 reference
matched by identifier from
InChIKey
InChIKey
KLKLIUIRQAMTAJ-AREMUKBSSA-N
UniChem compound ID
106692510
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40904235
1 reference
matched by identifier from
InChIKey
InChIKey
KLKLIUIRQAMTAJ-AREMUKBSSA-N
DSSTOX compound identifier
DTXCID901333384
0 references
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