Name: Name:7-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Brand: Angene
SKU: AG0037ZD
Rating: 90 (10 reviews)

7-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

CAS No.:

17306-46-6

Catalog Number:

AG0037ZD

Molecular Formula:

C27H30O14

Molecular Weight:

578.5187

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Product Description

Catalog Number:

AG0037ZD

Chemical Name:

7-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

CAS Number:

17306-46-6

Molecular Formula:

C27H30O14

Molecular Weight:

578.5187

MDL Number:

MFCD00004150

IUPAC Name:

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one

InChI:

InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1

InChI Key:

RPMNUQRUHXIGHK-PYXJVEIZSA-N

SMILES:

OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O

EC Number:

241-335-4

UNII:

K86F9AKS2A

Properties

Complexity:

939

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

578.164g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

578.523g/mol

Monoisotopic Mass:

578.164g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

225A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2

Literature

Title	Journal
Exploration of natural compounds as sources of new bifunctional scaffolds targeting cholinesterases and beta amyloid aggregation: the case of chelerythrine.	Bioorganic & medicinal chemistry 20121115
Study on impurities in naringin extracted from Citrus grandis 'tomentosa'.	Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20120101
Antioxidative glycosides from the leaves of Ligustrum robustum.	Journal of natural products 20030601
Inhibitory activity of flavonoids and tannins against HIV-1 protease.	Biological & pharmaceutical bulletin 20000901
Inhibition of HIV activation in latently infected cells by flavonoid compounds.	AIDS research and human retroviruses 19960101

Properties