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(Q104393740)
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English
cajanol
group of stereoisomers with the chemical formula C₁₇H₁₆O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
isoflavanone
1 reference
inferred from
isoflavanone
isoflavonoid
0 references
mass
316.094688232
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₆O₆
0 references
canonical SMILES
O=C1C2=C(O)C=C(OC)C=C2OCC1C3=CC=C(O)C=C3OC
0 references
found in taxon
Cajanus cajan
3 references
stated in
Reversed-phase high-performance liquid chromatography of cajanus cajan phytoalexins
stated in
Two isoprenylated isoflavone phytoalexins from Cajanus cajan
stated in
Cajanol, a novel anticancer agent from Pigeonpea [Cajanus cajan (L.) Millsp.] roots, induces apoptosis in human breast cancer cells through a ROS-mediated mitochondrial pathway.
Identifiers
InChI
InChI=1S/C17H16O6/c1-21-10-6-13(19)16-15(7-10)23-8-12(17(16)20)11-4-3-9(18)5-14(11)22-2/h3-7,12,18-19H,8H2,1-2H3
0 references
InChIKey
RYYWWFXWFMYKJM-UHFFFAOYSA-N
0 references
CAS Registry Number
61020-70-0
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
442670
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
RYYWWFXWFMYKJM-UHFFFAOYSA-N
UniChem compound ID
1067046
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00976519
1 reference
matched by identifier from
InChIKey
InChIKey
RYYWWFXWFMYKJM-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0033924
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RYYWWFXWFMYKJM-UHFFFAOYSA-N
UNII
U192S21MNA
1 reference
matched by identifier from
InChIKey
InChIKey
RYYWWFXWFMYKJM-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12050499
1 reference
InChIKey
RYYWWFXWFMYKJM-UHFFFAOYSA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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