WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 600126
CAS#: 7084-24-4
Description: Chrysanthemin is an anthocyanin. It is the 3-glucoside of cyanidin. Chrysanthemin can be found in the roselle plant (Hibiscus sabdariffa, Malvaceae), different Japanese angiosperms, and Rhaponticum (Asteraceae). The biosynthesis of cyanidin 3-O-glucoside in Escherichia coli was demonstrated by mean of metabolic genetic engineering. In Arabidopsis thaliana, a glycosyltransferase, UGT79B1, is involved in the anthocyanin biosynthetic pathway. UGT79B1 protein converts cyanidin 3-O-glucoside to cyanidin 3-O-xylosyl(1→2)glucoside.
MedKoo Cat#: 600126
Name: Chrysanthemin
CAS#: 7084-24-4
Chemical Formula: C21H23ClO11
Exact Mass: 486.09289
Molecular Weight: 486.85
Elemental Analysis: C, 51.81; H, 4.76; Cl, 7.28; O, 36.15
Synonym:
IUPAC/Chemical Name: (2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol chloride
InChi Key: QZBOIIGRIHVNTM-KLJGKOGVSA-N
InChi Code: InChI=1S/C21H22O11.ClH/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8;/h1-5,16-22,27-29H,6-7H2,(H3-,23,24,25,26);1H/t16-,17-,18+,19-,20?,21+;/m1./s1
SMILES Code: O[C@H]1[C@@H](O[C+]2C(C3=CC=C(O)C(O)=C3)OC4=C(C(O)=CC(O)=C4)C2)O[C@H](CO)[C@@H](O)[C@@H]1O.[Cl-]
Appearance: Solid powder
Purity: >98% (or refer to the Certificate of Analysis)
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility: Soluble in DMSO.
Shelf Life: >2 years if stored properly
Drug Formulation: This drug may be formulated in DMSO
Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code: 2934.99.9001
The following data is based on the product molecular weight 486.85 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
|---|---|---|---|
| 1 mM | 1.15 mL | 5.76 mL | 11.51 mL |
| 5 mM | 0.23 mL | 1.15 mL | 2.3 mL |
| 10 mM | 0.12 mL | 0.58 mL | 1.15 mL |
| 50 mM | 0.02 mL | 0.12 mL | 0.23 mL |
1: Soto-Rojo R, Baldenebro-López J, Flores-HolguÃn N, Glossman-Mitnik D. Comparison of several protocols for the computational prediction of the maximum absorption wavelength of chrysanthemin. J Mol Model. 2014 Aug;20(8):2378. doi: 10.1007/s00894-014-2378-2. Epub 2014 Jul 25. PubMed PMID: 25060149.
