Hmdb loader
You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on Human Metabolome Database.
Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2006-05-22 14:17:49 UTC
Update Date2021-09-14 15:44:46 UTC
HMDB IDHMDB0002353
Secondary Accession Numbers
  • HMDB02353
Metabolite Identification
Common NameDicrocin
DescriptionDicrocin is a water-soluble crocetin glycoside, a carotenoid pigment of saffron (Crocus sativus L.) that has been used as a spice for flavoring and coloring food preparations, and in Chinese traditional medicine as an anodyne or tranquilizer. Saffron is now used worldwide in folk medicine and is reputed to be useful in treating various human disorders such as heart and blood disorders. Stroke and heart attack are involved in reputed folkloric uses of saffron. Saffron is orally administrated as a decoction. Saffron extract exerts a protective effect on renal ischemia reperfusion induced oxidative damage in rats. (PMID: 17215084 ). Crocetin esters present in saffron stigmas and in Gardenia jasminoides Ellis fruit are the compounds responsible for their color. (PMID: 16448211 ).
Structure
Data?1582752245
Synonyms
ValueSource
Crocetin di-(beta-D-glucosyl)-esterHMDB
Crocetin di-(beta-delta-glucosyl)-esterHMDB
(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acidHMDB
Chemical FormulaC32H44O14
Average Molecular Weight652.6834
Monoisotopic Molecular Weight652.273106116
IUPAC Name(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate
Traditional Namedicrocin
CAS Registry Number57710-64-2
SMILES
OC[C@H]1OC(OC(=O)C(\C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChI Identifier
InChI=1S/C32H44O14/c1-17(11-7-13-19(3)29(41)45-31-27(39)25(37)23(35)21(15-33)43-31)9-5-6-10-18(2)12-8-14-20(4)30(42)46-32-28(40)26(38)24(36)22(16-34)44-32/h5-14,21-28,31-40H,15-16H2,1-4H3/b6-5+,11-7+,12-8+,17-9+,18-10+,19-13+,20-14+/t21-,22-,23-,24-,25+,26+,27-,28-,31+,32?/m1/s1
InChI KeyQBZWPZHDUZGTLS-BLVFRQJQSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as diterpenoids. These are terpene compounds formed by four isoprene units.
KingdomOrganic compounds
Super ClassLipids and lipid-like molecules
ClassPrenol lipids
Sub ClassDiterpenoids
Direct ParentDiterpenoids
Alternative Parents
Substituents
  • Diterpenoid
  • Fatty acid ester
  • Dicarboxylic acid or derivatives
  • Monosaccharide
  • Fatty acyl
  • Oxane
  • Enoate ester
  • Alpha,beta-unsaturated carboxylic ester
  • Secondary alcohol
  • Carboxylic acid ester
  • Polyol
  • Organoheterocyclic compound
  • Oxacycle
  • Carboxylic acid derivative
  • Acetal
  • Primary alcohol
  • Organooxygen compound
  • Hydrocarbon derivative
  • Organic oxide
  • Organic oxygen compound
  • Carbonyl group
  • Alcohol
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Disposition

Biological location

Source

Route of exposure

Physical Properties
StateSolid
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
Water Solubility0.16 g/LALOGPS
logP10(1.56) g/LALOGPS
logP10(0.33) g/LChemAxon
logS10(-3.6) g/LALOGPS
pKa (Strongest Acidic)11.89ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count12ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area232.9 ŲChemAxon
Rotatable Bond Count14ChemAxon
Refractivity168.66 m³·mol⁻¹ChemAxon
Polarizability69.2 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
DicrocinOC[C@H]1OC(OC(=O)C(\C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O6753.7Standard polar33892256
DicrocinOC[C@H]1OC(OC(=O)C(\C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O5181.1Standard non polar33892256
DicrocinOC[C@H]1OC(OC(=O)C(\C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O5415.4Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Dicrocin,1TMS,isomer #1CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5125.3Semi standard non polar33892256
Dicrocin,1TMS,isomer #2CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5125.7Semi standard non polar33892256
Dicrocin,1TMS,isomer #3CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O5102.5Semi standard non polar33892256
Dicrocin,1TMS,isomer #4CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O5081.8Semi standard non polar33892256
Dicrocin,1TMS,isomer #5CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C5097.8Semi standard non polar33892256
Dicrocin,1TMS,isomer #6CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5145.0Semi standard non polar33892256
Dicrocin,1TMS,isomer #7CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5098.2Semi standard non polar33892256
Dicrocin,1TMS,isomer #8CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5110.5Semi standard non polar33892256
Dicrocin,2TMS,isomer #1CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5022.8Semi standard non polar33892256
Dicrocin,2TMS,isomer #10CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5059.4Semi standard non polar33892256
Dicrocin,2TMS,isomer #11CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O5019.1Semi standard non polar33892256
Dicrocin,2TMS,isomer #12CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O5017.6Semi standard non polar33892256
Dicrocin,2TMS,isomer #13CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C5020.5Semi standard non polar33892256
Dicrocin,2TMS,isomer #14CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O5006.4Semi standard non polar33892256
Dicrocin,2TMS,isomer #15CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4997.1Semi standard non polar33892256
Dicrocin,2TMS,isomer #16CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O5038.9Semi standard non polar33892256
Dicrocin,2TMS,isomer #17CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O4987.4Semi standard non polar33892256
Dicrocin,2TMS,isomer #18CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C4991.2Semi standard non polar33892256
Dicrocin,2TMS,isomer #19CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4992.4Semi standard non polar33892256
Dicrocin,2TMS,isomer #2CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5026.7Semi standard non polar33892256
Dicrocin,2TMS,isomer #20CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4983.6Semi standard non polar33892256
Dicrocin,2TMS,isomer #21CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O5022.6Semi standard non polar33892256
Dicrocin,2TMS,isomer #22CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C5000.6Semi standard non polar33892256
Dicrocin,2TMS,isomer #23CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4998.5Semi standard non polar33892256
Dicrocin,2TMS,isomer #24CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4986.6Semi standard non polar33892256
Dicrocin,2TMS,isomer #25CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C5032.1Semi standard non polar33892256
Dicrocin,2TMS,isomer #26CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5045.8Semi standard non polar33892256
Dicrocin,2TMS,isomer #27CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5025.5Semi standard non polar33892256
Dicrocin,2TMS,isomer #28CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5000.0Semi standard non polar33892256
Dicrocin,2TMS,isomer #3CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5068.7Semi standard non polar33892256
Dicrocin,2TMS,isomer #4CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5034.3Semi standard non polar33892256
Dicrocin,2TMS,isomer #5CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O5010.5Semi standard non polar33892256
Dicrocin,2TMS,isomer #6CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4995.0Semi standard non polar33892256
Dicrocin,2TMS,isomer #7CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C5007.1Semi standard non polar33892256
Dicrocin,2TMS,isomer #8CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5021.4Semi standard non polar33892256
Dicrocin,2TMS,isomer #9CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5007.3Semi standard non polar33892256
Dicrocin,3TMS,isomer #1CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O4956.9Semi standard non polar33892256
Dicrocin,3TMS,isomer #10CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4938.0Semi standard non polar33892256
Dicrocin,3TMS,isomer #11CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4941.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #12CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O4967.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #13CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4968.2Semi standard non polar33892256
Dicrocin,3TMS,isomer #14CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4958.1Semi standard non polar33892256
Dicrocin,3TMS,isomer #15CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4962.3Semi standard non polar33892256
Dicrocin,3TMS,isomer #16CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4930.0Semi standard non polar33892256
Dicrocin,3TMS,isomer #17CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4932.7Semi standard non polar33892256
Dicrocin,3TMS,isomer #18CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4930.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #19CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O4922.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #2CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O4973.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #20CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C4920.0Semi standard non polar33892256
Dicrocin,3TMS,isomer #21CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C4935.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #22CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O4936.0Semi standard non polar33892256
Dicrocin,3TMS,isomer #23CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O4964.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #24CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4942.1Semi standard non polar33892256
Dicrocin,3TMS,isomer #25CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4945.3Semi standard non polar33892256
Dicrocin,3TMS,isomer #26CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4941.1Semi standard non polar33892256
Dicrocin,3TMS,isomer #27CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O4952.6Semi standard non polar33892256
Dicrocin,3TMS,isomer #28CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4937.9Semi standard non polar33892256
Dicrocin,3TMS,isomer #29CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4938.2Semi standard non polar33892256
Dicrocin,3TMS,isomer #3CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O4936.2Semi standard non polar33892256
Dicrocin,3TMS,isomer #30CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4935.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #31CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4965.6Semi standard non polar33892256
Dicrocin,3TMS,isomer #32CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4968.9Semi standard non polar33892256
Dicrocin,3TMS,isomer #33CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4963.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #34CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O4947.9Semi standard non polar33892256
Dicrocin,3TMS,isomer #35CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C4935.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #36CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C4954.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #37CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4939.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #38CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4967.2Semi standard non polar33892256
Dicrocin,3TMS,isomer #39CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O4934.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #4CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4938.2Semi standard non polar33892256
Dicrocin,3TMS,isomer #40CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C4932.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #41CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4954.7Semi standard non polar33892256
Dicrocin,3TMS,isomer #42CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O4930.6Semi standard non polar33892256
Dicrocin,3TMS,isomer #43CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C4927.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #44CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O4954.3Semi standard non polar33892256
Dicrocin,3TMS,isomer #45CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C4954.7Semi standard non polar33892256
Dicrocin,3TMS,isomer #46CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C4949.3Semi standard non polar33892256
Dicrocin,3TMS,isomer #47CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4930.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #48CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4958.7Semi standard non polar33892256
Dicrocin,3TMS,isomer #49CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C4943.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #5CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4928.0Semi standard non polar33892256
Dicrocin,3TMS,isomer #50CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O4944.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #51CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C4938.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #52CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C4964.2Semi standard non polar33892256
Dicrocin,3TMS,isomer #53CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4932.1Semi standard non polar33892256
Dicrocin,3TMS,isomer #54CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4959.5Semi standard non polar33892256
Dicrocin,3TMS,isomer #55CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4946.0Semi standard non polar33892256
Dicrocin,3TMS,isomer #56CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O4969.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #6CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C4932.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #7CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O4971.8Semi standard non polar33892256
Dicrocin,3TMS,isomer #8CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O4945.4Semi standard non polar33892256
Dicrocin,3TMS,isomer #9CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O4950.1Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #1CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5330.6Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #2CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5331.4Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #3CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O5301.5Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #4CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5287.2Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #5CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5287.7Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #6CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5319.4Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #7CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5302.8Semi standard non polar33892256
Dicrocin,1TBDMS,isomer #8CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5308.3Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #1CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5423.1Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #10CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5431.7Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #11CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O5421.2Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #12CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5434.9Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #13CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5418.3Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #14CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O5414.5Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #15CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O5414.8Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #16CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O5419.8Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #17CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5401.1Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #18CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5401.5Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #19CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5409.2Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #2CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5440.8Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #20CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5407.3Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #21CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5414.1Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #22CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C5411.4Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #23CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5403.1Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #24CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5401.6Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #25CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5408.6Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #26CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5426.1Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #27CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5416.0Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #28CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5410.3Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #3CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O5438.4Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #4CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5441.5Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #5CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O5420.6Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #6CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O5415.3Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #7CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C5409.4Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #8CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5424.9Semi standard non polar33892256
Dicrocin,2TBDMS,isomer #9CC(/C=C/C=C(\C)C(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O[C@@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O5423.5Semi standard non polar33892256
Spectra
Biological Properties
Cellular Locations
  • Extracellular
  • 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 IDFDB018633
KNApSAcK IDNot Available
Chemspider ID17216196
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound22833595
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 References
  1. Ochiai T, Shimeno H, Mishima K, Iwasaki K, Fujiwara M, Tanaka H, Shoyama Y, Toda A, Eyanagi R, Soeda S: Protective effects of carotenoids from saffron on neuronal injury in vitro and in vivo. Biochim Biophys Acta. 2007 Apr;1770(4):578-84. Epub 2006 Dec 5. [PubMed:17215084 ]
  2. Carmona M, Zalacain A, Sanchez AM, Novella JL, Alonso GL: Crocetin esters, picrocrocin and its related compounds present in Crocus sativus stigmas and Gardenia jasminoides fruits. Tentative identification of seven new compounds by LC-ESI-MS. J Agric Food Chem. 2006 Feb 8;54(3):973-9. [PubMed:16448211 ]