Quercetin 3-arabinoside

PubChem CID: 10252339

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Compound Synonyms	Quercetin 3-arabinoside, 4U8665F4X3, 3-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one, 5041-68-9, Guaiaverin, 2-(3,4-Bis(oxidanyl)phenyl)-3-((2R,3S,4S,5S)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl)oxy-5,7-bis(oxidanyl)chromen-4-one, 3-((2R,3R,4R,5S)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl)oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one, Quercetin 3-O-alpha-L-arabinoside, Quercetin 3-O-alpha-L-arabinopyranoside, Quercetin 3-L-arabinoside, Quercetin 3-O-arabinoside, SCHEMBL25174412, UNII-4U8665F4X3, CHEBI:167916, DTXSID701317338, Quercetin 3-beta-L-arabinofuranoside, QUERCETIN 3-.BETA.-L-ARABINOFURANOSIDE, 3-(.BETA.-L-ARABINOFURANOSYLOXY)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-4H-1-BENZOPYRAN-4-ONE, 3-(beta-L-Arabinofuranosyloxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one, 3-{[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one, 4H-1-BENZOPYRAN-4-ONE, 3-(.BETA.-L-ARABINOFURANOSYLOXY)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-, 4H-1-Benzopyran-4-one, 3-(beta-L-arabinofuranosyloxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-
Topological Polar Surface Area	186.0
Hydrogen Bond Donor Count	7.0
Heavy Atom Count	31.0
Description	obtained from leaves of guava (Psidium guajava ) and from other plants. Quercetin 3-arabinoside is found in many foods, some of which are star anise, common hazelnut, common walnut, and pear.
Isotope Atom Count	0.0
Molecular Complexity	711.0
Database Name	cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count	4.0
Iupac Name	3-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
Prediction Hob	0.0
Class	Diarylheptanoids
Xlogp	1.0
Superclass	Phenylpropanoids and polyketides
Subclass	Linear diarylheptanoids
Molecular Formula	C20H18O11
Prediction Swissadme	0.0
Inchi Key	BDCDNTVZSILEOY-BQCJVYABSA-N
Fcsp3	0.25
Logs	-3.867
Rotatable Bond Count	4.0
State	Solid
Logd	0.338
Synonyms	Foeniculin, Guaiaverin, Guaijaverin, Guajavarin, Quercetin 3-arabinoside, Quercetin 3-L-arabinoside, Quercetin 3-O-alpha-L-arabinopyranoside, Quercetin 3-O-alpha-L-arabinoside, Quercetin 3-O-arabinoside
Compound Name	Quercetin 3-arabinoside
Kingdom	Organic compounds
Prediction Hob Swissadme	0.0
Exact Mass	434.085
Formal Charge	0.0
Monoisotopic Mass	434.085
Hydrogen Bond Acceptor Count	11.0
Molecular Weight	434.3
Covalent Unit Count	1.0
Total Atom Stereocenter Count	4.0
Total Bond Stereocenter Count	0.0
Molecular Framework	Aromatic homomonocyclic compounds
Esol	-2.9029240838709685
Inchi	InChI=1S/C20H18O11/c21-6-13-15(26)17(28)20(30-13)31-19-16(27)14-11(25)4-8(22)5-12(14)29-18(19)7-1-2-9(23)10(24)3-7/h1-5,13,15,17,20-26,28H,6H2/t13-,15-,17+,20+/m0/s1
Smiles	C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@@H]4[C@@H]([C@H]([C@@H](O4)CO)O)O)O)O
Nring	4.0
Defined Bond Stereocenter Count	0.0
Taxonomy Direct Parent	Curcuminoids

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83. Outgoing r'ship FOUND_IN to/from Malus Communis (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Malus Domestica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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92. Outgoing r'ship FOUND_IN to/from Mitragyna Rotundifolia (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Nandina Domestica (Plant) Rel Props:Reference:
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95. Outgoing r'ship FOUND_IN to/from Pimpinella Anisum (Plant) Rel Props:Source_db:fooddb_chem_all
96. Outgoing r'ship FOUND_IN to/from Prunus Domestica (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Psidium Guajava (Plant) Rel Props:Source_db:fooddb_chem_all
98. Outgoing r'ship FOUND_IN to/from Pyrola Rotundifolia (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Pyrus Communis (Plant) Rel Props:Source_db:fooddb_chem_all
100. Outgoing r'ship FOUND_IN to/from Rotala Rotundifolia (Plant) Rel Props:Reference:
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107. Outgoing r'ship FOUND_IN to/from Vaccinium Ashei (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Vaccinium Bracteatum (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Vaccinium Corymbosum (Plant) Rel Props:Source_db:npass_chem_all
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114. Outgoing r'ship FOUND_IN to/from Vitex Rotundifolia (Plant) Rel Props:Reference:

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Quercetin 3-arabinoside

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Phytochemical Properties

Associated Connections 114

Plant Connections 114