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24699-16-9 | 9H-Xanthen-9-one, 4-β-D-glucopyranosyl-1,3,6,7-tetrahydroxy-
CAS No: 24699-16-9 Catalog No: AG002P2E MDL No:MFCD00238624
Product Description
Catalog Number:
AG002P2E
Chemical Name:
9H-Xanthen-9-one, 4-β-D-glucopyranosyl-1,3,6,7-tetrahydroxy-
CAS Number:
24699-16-9
Molecular Formula:
C19H18O11
Molecular Weight:
422.3396
MDL Number:
MFCD00238624
IUPAC Name:
1,3,6,7-tetrahydroxy-4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one
InChI:
InChI=1S/C19H18O11/c20-4-11-15(26)16(27)17(28)19(30-11)13-9(24)2-8(23)12-14(25)5-1-6(21)7(22)3-10(5)29-18(12)13/h1-3,11,15-17,19-24,26-28H,4H2/t11-,15-,16+,17-,19+/m1/s1
InChI Key:
CDYBOKJASDEORM-HBVDJMOISA-N
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)c1c(O)cc(c2c1oc1cc(O)c(cc1c2=O)O)O
Properties
Complexity:
646
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
422.085g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
8
Isotope Atom Count:
0
Molecular Weight:
422.342g/mol
Monoisotopic Mass:
422.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
197A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
Literature
| Title | Journal |
|---|---|
| Synthesis of mangiferin, isomangiferin, and homomangiferin. | The Journal of organic chemistry 20100820 |
| Isolation of isomangiferin from honeybush (Cyclopia subternata) using high-speed counter-current chromatography and high-performance liquid chromatography. | Journal of chromatography. A 20090508 |
| Rapid identification of polyphenol C-glycosides from Swertia franchetiana by HPLC-ESI-MS-MS. | Journal of chromatographic science 20090301 |
| [Chemical constituents from Polygala telephioides]. | Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20090201 |
| In vitro cultures of Cyclopia plants (honeybush) as a source of bioactive xanthones and flavanones. | Zeitschrift fur Naturforschung. C, Journal of biosciences 20090101 |
| Antioxidant C-glucosylxanthones from the leaves of Arrabidaea patellifera. | Journal of natural products 20081101 |
| Simultaneous determination of bioactive xanthone glycosides and norlignans from ethanolic extract of Anemarrhena asphodeloides by liquid chromatography. | Journal of AOAC International 20080101 |
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