Compound Selection

Formula: C21H20O13

MW: 480.38

CAS: 652-78-8

TNP NUMBER: TNP00280

MDL NUMBER: MFCD00017429

IUPAC: 8-[((2S,5S,3R,4R,6R)-3,4,5,6-tetrahydroxy(2H-3,4,5,6-tetrahydropyran-2-yl))met hoxy]-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one

Smiles: c1(cc(c(c2c1c(c(c(o2)c1ccc(c(c1)O)O)O)=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O

THERAPEUTIC CATEGORY: antioxidant, anti-inflammatory

REFERENCE: Ajaikumar B. Kunnumakkara1, Asha S. Nair1, Kwang Seok Ahn1, Manoj K. Pandey1, Zhengfang Yi2, Mingyao Liu2, and Bharat B. Aggarwal Blood, 15 June 2007, Vol. 109, No. 12, pp. 5112-5121.

SOURCE: Gossypin is an antioxidant, anti-inflammatory flavone extracted from Hibiscus vitifolius, also known as tropical rose mallow, a perennial shrub.

ACCEPTORS: 13

DONORS: 9

ROTATION BONDS: 8

N+O: 13

Chiral Centers: 5

LogP: -3.81

LogS: -2.13

LIPINSKI: 2

Synonyms: GOSSYPIN HPLC GRADE

CAS:

MF:

MW:0

EINECS:

Product Categories: GOSSYPIN HPLC GRADE GOSSYPIN HPLC GRADE

Usage And Synthesis: GOSSYPIN HPLC GRADE

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