CAS 14259-47-3 | (S)-7-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-benzopyran-4-one | CAS Number 14259-47-3

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Other Building Blocks > 14259-47-3

14259-47-3 | (S)-7-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-benzopyran-4-one

CAS No: 14259-47-3 Catalog No: AG0034PP MDL No:MFCD00151177

Product Description

Catalog Number:

AG0034PP

Chemical Name:

(S)-7-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-benzopyran-4-one

CAS Number:

14259-47-3

Molecular Formula:

C28H34O14

Molecular Weight:

594.5612

MDL Number:

MFCD00151177

IUPAC Name:

(2S)-5-hydroxy-2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one

InChI:

InChI=1S/C28H34O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-29,31-36H,9-10H2,1-2H3/t11-,17-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1

InChI Key:

RMCRQBAILCLJGU-HIBKWJPLSA-N

SMILES:

COc1ccc(cc1)[C@@H]1CC(=O)c2c(O1)cc(cc2O)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O

EC Number:

238-139-6

Properties

Complexity:

900

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

594.195g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

594.566g/mol

Monoisotopic Mass:

594.195g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

214A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.7

Literature

Title	Journal
Didymin induces apoptosis through mitochondrial dysfunction and up-regulation of RKIP in human hepatoma cells.	Chemico-biological interactions 20170105
Grapefruit (Citrus paradisi Macfad) phytochemicals composition is modulated by household processing techniques.	Journal of food science 20120901
Didymin induces apoptosis by inhibiting N-Myc and upregulating RKIP in neuroblastoma.	Cancer prevention research (Philadelphia, Pa.) 20120301
Didymin, a dietary flavonoid glycoside from citrus fruits, induces Fas-mediated apoptotic pathway in human non-small-cell lung cancer cells in vitro and in vivo.	Lung cancer (Amsterdam, Netherlands) 20100601