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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 18:00:37 UTC
Update Date2022-03-07 02:53:39 UTC
HMDB IDHMDB0033296
Secondary Accession Numbers
  • HMDB33296
Metabolite Identification
Common NameKuwanon Y
DescriptionKuwanon Y belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain. Kuwanon Y has been detected, but not quantified in, fruits. This could make kuwanon y a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Kuwanon Y.
Structure
Data?1563862383
Synonyms
ValueSource
Kuwanon yMeSH
Chemical FormulaC34H30O9
Average Molecular Weight582.5966
Monoisotopic Molecular Weight582.188982558
IUPAC Name2-[6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]benzene-1,3-diol
Traditional Name2-[6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]benzene-1,3-diol
CAS Registry Number105016-28-2
SMILES
CC1=CC(C(C(C1)C1=C(O)C=C(O)C=C1)C(=O)C1=C(O)C=C(O)C=C1)C1=C(O)C=C(\C=C\C2=C(O)C=C(O)C=C2)C=C1O
InChI Identifier
InChI=1S/C34H30O9/c1-17-10-25(23-8-6-21(36)15-28(23)39)32(34(43)24-9-7-22(37)16-29(24)40)26(11-17)33-30(41)12-18(13-31(33)42)2-3-19-4-5-20(35)14-27(19)38/h2-9,11-16,25-26,32,35-42H,10H2,1H3/b3-2+
InChI KeyYYUHPJKWIHNMSV-NSCUHMNNSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassDiarylheptanoids
Sub ClassLinear diarylheptanoids
Direct ParentLinear diarylheptanoids
Alternative Parents
Substituents
  • Linear 1,7-diphenylheptane skeleton
  • Stilbene
  • Alkyl-phenylketone
  • Phenylketone
  • Benzoyl
  • Resorcinol
  • Aryl alkyl ketone
  • Aryl ketone
  • Styrene
  • 1-hydroxy-4-unsubstituted benzenoid
  • 1-hydroxy-2-unsubstituted benzenoid
  • Phenol
  • Monocyclic benzene moiety
  • Benzenoid
  • Vinylogous acid
  • Ketone
  • Hydrocarbon derivative
  • Organooxygen compound
  • Organic oxide
  • Organic oxygen compound
  • Aromatic homomonocyclic compound
Molecular FrameworkAromatic homomonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
Role
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water Solubility0.00082 mg/L @ 25 °C (est)The Good Scents Company Information System
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility0.0042 g/LALOGPS
logP4.33ALOGPS
logP6.93ChemAxon
logS-5.1ALOGPS
pKa (Strongest Acidic)7.8ChemAxon
pKa (Strongest Basic)-3.9ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count9ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area178.91 ŲChemAxon
Rotatable Bond Count6ChemAxon
Refractivity163.65 m³·mol⁻¹ChemAxon
Polarizability60.9 ųChemAxon
Number of Rings5ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+225.80130932474
DeepCCS[M-H]-223.97630932474
DeepCCS[M-2H]-257.21830932474
DeepCCS[M+Na]+231.41730932474
AllCCS[M+H]+244.532859911
AllCCS[M+H-H2O]+242.832859911
AllCCS[M+NH4]+245.932859911
AllCCS[M+Na]+246.432859911
AllCCS[M-H]-225.232859911
AllCCS[M+Na-2H]-226.632859911
AllCCS[M+HCOO]-228.332859911

Predicted Kovats Retention Indices

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Kuwanon Y,1TMS,isomer #1CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15793.5Semi standard non polar33892256
Kuwanon Y,1TMS,isomer #2CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15848.2Semi standard non polar33892256
Kuwanon Y,1TMS,isomer #3CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15768.3Semi standard non polar33892256
Kuwanon Y,1TMS,isomer #4CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15845.4Semi standard non polar33892256
Kuwanon Y,1TMS,isomer #5CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15809.3Semi standard non polar33892256
Kuwanon Y,1TMS,isomer #6CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15800.0Semi standard non polar33892256
Kuwanon Y,1TMS,isomer #7CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15850.0Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #1CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15774.8Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #10CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15817.1Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #11CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15779.8Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #12CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15761.0Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #13CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15783.9Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #14CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15762.7Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #15CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15772.8Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #16CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15799.8Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #17CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15820.4Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #18CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15802.5Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #19CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15834.7Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #2CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15788.8Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #20CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15810.0Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #21CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15795.0Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #22CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15814.3Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #3CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15769.4Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #4CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15780.9Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #5CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15742.9Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #6CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15799.0Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #7CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15808.7Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #8CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15824.4Semi standard non polar33892256
Kuwanon Y,2TMS,isomer #9CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15807.7Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #1CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15783.6Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #10CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15701.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #11CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15681.2Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #12CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15722.6Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #13CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15706.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #14CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15709.7Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #15CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15687.3Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #16CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15728.9Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #17CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15793.2Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #18CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15712.6Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #19CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15724.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #2CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15701.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #20CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15699.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #21CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15739.8Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #22CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15712.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #23CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15694.8Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #24CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15735.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #25CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15698.4Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #26CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15739.9Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #27CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15725.3Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #28CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15810.1Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #29CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15753.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #3CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15713.4Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #30CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15762.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #31CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15743.4Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #32CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15754.3Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #33CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15745.7Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #34CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15746.7Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #35CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15790.6Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #36CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15715.2Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #37CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15725.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #38CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15711.7Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #39CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15807.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #4CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15688.7Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #40CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15821.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #41CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15740.0Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #5CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15723.9Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #6CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15714.1Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #7CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15692.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #8CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15676.5Semi standard non polar33892256
Kuwanon Y,3TMS,isomer #9CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15717.5Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #1CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15541.2Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #10CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15450.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #11CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15558.7Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #12CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15465.4Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #13CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15537.6Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #14CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15448.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #15CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15547.6Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #16CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15436.5Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #17CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15523.3Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #18CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15450.2Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #19CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15520.7Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #2CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15553.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #20CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15452.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #21CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15526.9Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #22CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15519.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #23CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15439.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #24CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15530.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #25CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15523.3Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #26CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15568.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #27CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15574.7Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #28CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15561.6Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #29CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15659.2Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #3CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15532.6Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #30CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15481.0Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #31CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15478.4Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #32CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15559.7Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #33CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15473.5Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #34CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15573.6Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #35CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15551.3Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #36CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15469.4Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #37CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15544.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #38CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15545.4Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #39CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O[Si](C)(C)C)C=C2O)C15540.6Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #4CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15640.0Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #40CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15680.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #41CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15683.9Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #42CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15678.9Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #43CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15593.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #44CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15584.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #45CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15587.8Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #46CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O)C15564.9Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #47CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15581.2Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #48CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15581.5Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #49CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C15487.4Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #5CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15551.9Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #50CC1=CC(C2=C(O[Si](C)(C)C)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C15596.1Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #6CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15462.2Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #7CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15444.3Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #8CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C)C15541.9Semi standard non polar33892256
Kuwanon Y,4TMS,isomer #9CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C)C=C3O)C=C2O[Si](C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C)C=C2O[Si](C)(C)C)C15458.8Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #1CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C16102.5Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #2CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C16134.4Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #3CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O)C=C2O)C16080.3Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #4CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C16130.5Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #5CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16120.5Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #6CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C(C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16113.1Semi standard non polar33892256
Kuwanon Y,1TBDMS,isomer #7CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16135.3Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #1CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C16362.6Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #10CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C16392.1Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #11CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C16370.3Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #12CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O)C=C2O)C16364.9Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #13CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O)C=C2O)C16381.2Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #14CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C(C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O)C=C2O)C16373.6Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #15CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O)C=C2O)C16364.9Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #16CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C16390.4Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #17CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C16401.7Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #18CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C(C)(C)C)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O)C16391.2Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #19CC1=CC(C2=C(O[Si](C)(C)C(C)(C)C)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16425.8Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #2CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C16374.2Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #20CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16398.6Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #21CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C(C)(C)C)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16394.4Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #22CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O)C16395.3Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #3CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C(C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C16365.7Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #4CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C(C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C16366.2Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #5CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C(C2=CC=C(O)C=C2O[Si](C)(C)C(C)(C)C)C16342.8Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #6CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O[Si](C)(C)C(C)(C)C)C16366.9Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #7CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O)C=C2O[Si](C)(C)C(C)(C)C)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C16390.3Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #8CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3O)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C16400.6Semi standard non polar33892256
Kuwanon Y,2TBDMS,isomer #9CC1=CC(C2=C(O)C=C(/C=C/C3=CC=C(O)C=C3O[Si](C)(C)C(C)(C)C)C=C2O)C(C(=O)C2=CC=C(O)C=C2O)C(C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2O)C16391.5Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (Non-derivatized) - 70eV, Positivesplash10-090a-5967420000-2ad6d3ff4bc6e8691ebd2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (1 TMS) - 70eV, Positivesplash10-000i-6698038000-b3c7f9cdaefc88bd3a332017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS ("Kuwanon Y,1TMS,#1" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_1_2) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_1_3) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_1_4) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_1_5) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_1_6) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_1_7) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_1) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_2) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_3) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_4) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_5) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_6) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_7) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_8) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_9) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_10) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_11) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_12) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_13) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_14) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_15) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Kuwanon Y GC-MS (TMS_2_16) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 10V, Positive-QTOFsplash10-001i-0211590000-0a3d316334b3e93abbaf2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 20V, Positive-QTOFsplash10-0079-0932750000-8bc682c84a9463f4bfca2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 40V, Positive-QTOFsplash10-052r-0976220000-a4c1972d049967962ec42016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 10V, Negative-QTOFsplash10-001i-0000090000-c1024a32faecbe6a31842016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 20V, Negative-QTOFsplash10-001l-0130190000-de6c5d451469467324b62016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 40V, Negative-QTOFsplash10-0a4s-0675090000-fd669b32602977437a7f2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 10V, Negative-QTOFsplash10-001i-0000090000-c0b654bdd9ad61dacac82021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 20V, Negative-QTOFsplash10-001r-0530390000-cc5510702bfb9b71b5c62021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 40V, Negative-QTOFsplash10-0fc0-2691560000-64682001b881620d0e662021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 10V, Positive-QTOFsplash10-001i-0021490000-74b242fedf8ecf974b4c2021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 20V, Positive-QTOFsplash10-00o0-0351590000-3bcae79a6099729e48532021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Kuwanon Y 40V, Positive-QTOFsplash10-069c-1231790000-719c35a7ae1a506a0dd72021-09-25Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Membrane
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 IDFDB011320
KNApSAcK IDC00008098
Chemspider ID35013582
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound14334305
PDB IDNot Available
ChEBI ID172757
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1834561
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .