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(Q82946020)
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English
Dinklagin A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavanone
0 references
2-(2,2-dimethylchromen-6-yl)-7-hydroxy-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
1 reference
based on heuristic
inferred from SMILES
mass
390.183109312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₂₆O₄
0 references
canonical SMILES
O=C1C2=CC(=C(O)C=C2OC(C=3C=CC=4OC(C=CC4C3)(C)C)C1)CC=C(C)C
0 references
isomeric SMILES
CC(C)=CCc1cc2c(cc1O)O[C@H](c1ccc3c(c1)C=CC(C)(C)O3)CC2=O
0 references
found in taxon
Dorstenia dinklagei
3 references
stated in
Dinklagins A, B and C: three prenylated flavonoids and other constituents from the twigs of Dorstenia dinklagei
stated in
Dinklagins A, B and C: three prenylated flavonoids and other constituents from the twigs of Dorstenia dinklagei
stated in
Dinklagins A, B and C: three prenylated flavonoids and other constituents from the twigs of Dorstenia dinklagei
Identifiers
InChI
InChI=1S/C25H26O4/c1-15(2)5-6-16-12-19-21(27)14-23(28-24(19)13-20(16)26)17-7-8-22-18(11-17)9-10-25(3,4)29-22/h5,7-13,23,26H,6,14H2,1-4H3/t23-/m0/s1
0 references
InChIKey
XPMXYEFQBQWMEC-QHCPKHFHSA-N
0 references
CAS Registry Number
487010-46-8
0 references
PubChem CID
636494
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XPMXYEFQBQWMEC-QHCPKHFHSA-N
UniChem compound ID
45540983
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90964102
1 reference
matched by identifier from
InChIKey
InChIKey
XPMXYEFQBQWMEC-QHCPKHFHSA-N
DSSTOX compound identifier
DTXCID501391813
0 references
LIPID MAPS ID
LMPK12140057
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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