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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2019-10-11 15:11:28 UTC
Update Date2022-03-07 03:18:18 UTC
HMDB IDHMDB0240523
Secondary Accession NumbersNone
Metabolite Identification
Common NameHesperetin 5-glucuronide
DescriptionHesperetin 5-glucuronide belongs to the class of organic compounds known as flavonoid o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid. Based on a literature review very few articles have been published on Hesperetin 5-glucuronide.
Structure
Thumb
Synonyms
ValueSource
(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-{[7-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-5-yl]oxy}oxane-2-carboxylateHMDB
Chemical FormulaC22H22O12
Average Molecular Weight478.406
Monoisotopic Molecular Weight478.111126148
IUPAC Name(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[7-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-5-yl]oxy}oxane-2-carboxylic acid
Traditional Name(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[7-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-2,3-dihydro-1-benzopyran-5-yl]oxy}oxane-2-carboxylic acid
CAS Registry NumberNot Available
SMILES
[H]C1(CC(=O)C2=C(O1)C=C(O)C=C2O[C@]1([H])O[C@]([H])(C(O)=O)[C@@]([H])(O)[C@]([H])(O)[C@@]1([H])O)C1=CC(O)=C(OC)C=C1
InChI Identifier
InChI=1S/C22H22O12/c1-31-12-3-2-8(4-10(12)24)13-7-11(25)16-14(32-13)5-9(23)6-15(16)33-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-6,13,17-20,22-24,26-28H,7H2,1H3,(H,29,30)/t13?,17-,18-,19+,20-,22+/m0/s1
InChI KeyCBVJYALZVWCCEC-WDXLFLMVSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as flavonoid o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid.
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassFlavonoids
Sub ClassFlavonoid glycosides
Direct ParentFlavonoid O-glucuronides
Alternative Parents
Substituents
  • Flavonoid-5-o-glucuronide
  • 4p-methoxyflavonoid-skeleton
  • 3'-hydroxyflavonoid
  • 7-hydroxyflavonoid
  • Flavanone
  • Hydroxyflavonoid
  • Flavan
  • Phenolic glycoside
  • 1-o-glucuronide
  • O-glucuronide
  • Glucuronic acid or derivatives
  • Chromone
  • Glycosyl compound
  • O-glycosyl compound
  • Chromane
  • Benzopyran
  • Methoxyphenol
  • 1-benzopyran
  • Phenoxy compound
  • Anisole
  • Methoxybenzene
  • Aryl alkyl ketone
  • Aryl ketone
  • Phenol ether
  • Phenol
  • 1-hydroxy-2-unsubstituted benzenoid
  • Alkyl aryl ether
  • 1-hydroxy-4-unsubstituted benzenoid
  • Beta-hydroxy acid
  • Monosaccharide
  • Monocyclic benzene moiety
  • Hydroxy acid
  • Benzenoid
  • Pyran
  • Oxane
  • Ketone
  • Secondary alcohol
  • Acetal
  • Polyol
  • Monocarboxylic acid or derivatives
  • Organoheterocyclic compound
  • Oxacycle
  • Ether
  • Carboxylic acid derivative
  • Carboxylic acid
  • Hydrocarbon derivative
  • Organic oxide
  • Aldehyde
  • Organic oxygen compound
  • Carbonyl group
  • Organooxygen compound
  • Alcohol
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
RoleNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP0.74ALOGPS
logP0.08ChemAxon
logS-2.4ALOGPS
pKa (Strongest Acidic)2.77ChemAxon
pKa (Strongest Basic)-3.7ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count12ChemAxon
Hydrogen Donor Count6ChemAxon
Polar Surface Area192.44 ŲChemAxon
Rotatable Bond Count5ChemAxon
Refractivity109.76 m³·mol⁻¹ChemAxon
Polarizability45.87 ųChemAxon
Number of Rings4ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+201.5430932474
DeepCCS[M-H]-199.88730932474
DeepCCS[M-2H]-233.92430932474
DeepCCS[M+Na]+207.69730932474

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Hesperetin 5-glucuronide[H]C1(CC(=O)C2=C(O1)C=C(O)C=C2O[C@]1([H])O[C@]([H])(C(O)=O)[C@@]([H])(O)[C@]([H])(O)[C@@]1([H])O)C1=CC(O)=C(OC)C=C15593.6Standard polar33892256
Hesperetin 5-glucuronide[H]C1(CC(=O)C2=C(O1)C=C(O)C=C2O[C@]1([H])O[C@]([H])(C(O)=O)[C@@]([H])(O)[C@]([H])(O)[C@@]1([H])O)C1=CC(O)=C(OC)C=C13962.0Standard non polar33892256
Hesperetin 5-glucuronide[H]C1(CC(=O)C2=C(O1)C=C(O)C=C2O[C@]1([H])O[C@]([H])(C(O)=O)[C@@]([H])(O)[C@]([H])(O)[C@@]1([H])O)C1=CC(O)=C(OC)C=C14481.9Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Hesperetin 5-glucuronide,1TMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O4107.3Semi standard non polar33892256
Hesperetin 5-glucuronide,1TMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O4108.3Semi standard non polar33892256
Hesperetin 5-glucuronide,1TMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4111.1Semi standard non polar33892256
Hesperetin 5-glucuronide,1TMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O4103.5Semi standard non polar33892256
Hesperetin 5-glucuronide,1TMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O4112.0Semi standard non polar33892256
Hesperetin 5-glucuronide,1TMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C4107.2Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O4032.2Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #10COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O4009.1Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #11COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O4027.5Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #12COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C4037.7Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #13COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O4003.5Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #14COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C4008.9Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #15COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C4039.8Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4020.8Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O4007.9Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O4022.5Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C4061.8Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4024.2Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #7COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O3993.1Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #8COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O4017.3Semi standard non polar33892256
Hesperetin 5-glucuronide,2TMS,isomer #9COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C4025.8Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O3990.4Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #10COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3998.9Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #11COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O3955.8Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #12COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O3973.1Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #13COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C3985.9Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #14COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3945.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #15COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3942.4Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #16COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3986.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #17COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3952.9Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #18COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3983.2Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #19COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3990.7Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O3965.1Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #20COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3974.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O3993.5Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C4003.1Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O3973.2Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O3987.7Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #7COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C4006.1Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #8COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3963.5Semi standard non polar33892256
Hesperetin 5-glucuronide,3TMS,isomer #9COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3987.5Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O3955.3Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #10COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3967.9Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #11COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3941.1Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #12COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3925.1Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #13COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3950.0Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #14COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3925.5Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #15COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3940.0Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O3974.3Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C3981.4Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3947.0Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3960.0Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3976.1Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #7COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3959.8Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #8COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3976.5Semi standard non polar33892256
Hesperetin 5-glucuronide,4TMS,isomer #9COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3978.7Semi standard non polar33892256
Hesperetin 5-glucuronide,5TMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O3956.9Semi standard non polar33892256
Hesperetin 5-glucuronide,5TMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C3949.2Semi standard non polar33892256
Hesperetin 5-glucuronide,5TMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3969.1Semi standard non polar33892256
Hesperetin 5-glucuronide,5TMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3942.1Semi standard non polar33892256
Hesperetin 5-glucuronide,5TMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3965.2Semi standard non polar33892256
Hesperetin 5-glucuronide,5TMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)O2)C=C1O[Si](C)(C)C3933.0Semi standard non polar33892256
Hesperetin 5-glucuronide,1TBDMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O4385.9Semi standard non polar33892256
Hesperetin 5-glucuronide,1TBDMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O4394.9Semi standard non polar33892256
Hesperetin 5-glucuronide,1TBDMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4352.1Semi standard non polar33892256
Hesperetin 5-glucuronide,1TBDMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4349.5Semi standard non polar33892256
Hesperetin 5-glucuronide,1TBDMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4360.2Semi standard non polar33892256
Hesperetin 5-glucuronide,1TBDMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4378.1Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O4542.8Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #10COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4444.4Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #11COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4459.2Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #12COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4481.0Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #13COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4445.5Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #14COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4471.9Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #15COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O[Si](C)(C)C(C)(C)C4496.4Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4519.6Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4526.6Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4542.6Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4553.8Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4502.3Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #7COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4484.8Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #8COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4503.7Semi standard non polar33892256
Hesperetin 5-glucuronide,2TBDMS,isomer #9COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4524.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #1COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O4698.9Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #10COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O[Si](C)(C)C(C)(C)C4711.8Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #11COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4613.4Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #12COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4658.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #13COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4647.5Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #14COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4615.0Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #15COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4631.5Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #16COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O[Si](C)(C)C(C)(C)C4653.2Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #17COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4567.5Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #18COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4595.8Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #19COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O[Si](C)(C)C(C)(C)C4612.7Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #2COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4690.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #20COC1=CC=C(C2CC(=O)C3=C(C=C(O)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O[Si](C)(C)C(C)(C)C4599.3Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #3COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4715.2Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #4COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4716.4Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #5COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O4668.9Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #6COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4699.0Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #7COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4701.1Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #8COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)O2)C=C1O4682.1Semi standard non polar33892256
Hesperetin 5-glucuronide,3TBDMS,isomer #9COC1=CC=C(C2CC(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)O2)C=C1O[Si](C)(C)C(C)(C)C4701.9Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Hesperetin 5-glucuronide GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Hesperetin 5-glucuronide GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Hesperetin 5-glucuronide 10V, Negative-QTOFsplash10-004i-0000900000-2055daa3382fd02da5932021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Hesperetin 5-glucuronide 20V, Negative-QTOFsplash10-004i-0003900000-43bb92e773ac2e9c676f2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Hesperetin 5-glucuronide 40V, Negative-QTOFsplash10-0a5c-3915000000-e0cce435308cd83db7892021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Hesperetin 5-glucuronide 10V, Positive-QTOFsplash10-004i-0005900000-bc594dd82b6f8121c8662021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Hesperetin 5-glucuronide 20V, Positive-QTOFsplash10-0fb9-0009600000-2b5c1cd5516880506d952021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Hesperetin 5-glucuronide 40V, Positive-QTOFsplash10-004i-0209000000-a77ed1852f22cfa639ba2021-09-24Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB093716
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound101242746
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General ReferencesNot Available