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Chemical structure of Naringin
Flavanones

Naringin

柚皮苷

PHY-NP-01974 · Natural product research catalog

Catalog numberPHY-NP-01974
CAS number10236-47-2
Molecular formulaC27H32O14
Molecular weight580.539 g/mol
Chemical classFlavanones
Purity / assayConfirmed in quotation and batch COA

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Product information

Naringin is listed in the Flavanones section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
SMILESC[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O
InChIKeyDFPMSGMNTNDNHN-ZPHOTFPESA-N
Subclass / scaffoldFlavanones
PubChem CID442428

Computed properties & structure classification

Exact mass (Da)580.1792Predicted LogP-1.1652
Predicted TPSA (Ų)225.06H-bond donors8
H-bond acceptors14Rotatable bonds6
Ring count5Aromatic rings2
Fraction Csp³0.519Synthetic accessibility score4.74
QED score0.202Lipinski rule violations3
NPClassifier pathwayShikimates and PhenylpropanoidsNPClassifier superclassFlavonoids
NPClassifier classFlavanonesParent SMILESC[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Parent formulaC27H32O14Parent molecular weight580.539
Specified stereocenters11Unspecified stereocenters0

Structure-derived values from the supplied dataset; not measured batch specifications or experimentally verified activity.

Reported natural occurrence

Main reported sourceCitrus paradisi
LOTUS / Wikidata speciesCitrus × paradisi(葡萄柚)[24];Citrus grandis(柚)[4];Citrus reticulata(橘)[4];Citrus × deliciosa(地中海红橘)[4];pomelo(柚子)[4];Citrus japonica(金柑)[2];Citrus unshiu(温州蜜柑)[2];Origanum majoricum[2];Poncirus trifoliata(枳)[2];Rosmarinus officinalis(迷迭香)[2];citron(枸橼)[2];Ailanthus integrifolia(伯克臭椿)[1];Citrus latipes(凯西大翼橙)[1];Citrus sudachi(酢橘)[1];Coriandrum sativum(芫荽)[1];…
Source familiesRutaceae[15];Lamiaceae[4];Polypodiaceae[4];Daphniphyllaceae[3];Apiaceae[2];Simaroubaceae[1]
Genus / family recordscumquat(金橘)[2];Citrus(柑橘属)[1];Thymus(百里香属)[1]
LOTUS species records37
LOTUS reference records52
COCONUT occurrence recordsAceriphyllum rossii;Adiantum sp.;Ageratum conyzoides;Agnorhiza bolanderi;Ailanthus integrifolia;Alligator mississippiensis;Anaxagorea clavata;Aplidium constellatum;Araujia sericifera;Aria pallescens;Arnica nevadensis;Artemisia monogyna;Astragalus membranaceus;Astragalus mongholicus;Bassia butyracea;Beyeria brevifolia;Blumea glomerata;Bursaria spinosa;Centaurea spinosa;Chloranthus tianmushanensis;Chromolaena odorata;Chromolaena pulchella;Cicer arietinum;Citrus;Citrus Aurantium;Citrus Grandis;Citrus Paradisi;Citrus Reticulata;Citrus aurantium;Citrus grandis;…
COCONUT organism records154
COCONUT identifierCNP0268019.2

Occurrence records are inherited from the supplied dataset. They do not establish manufacturing origin, batch traceability or independent literature verification. Taxonomic names may include synonyms.

Structure resources

Documents & specifications

Certificate of analysis (COA)Batch-specific document pending; not available in this preview
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

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