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3,5-DIHYDROXY-4'-METHOXYSTILBENE 3-O-BETA-D-GLUCOSIDE

CAS：30197-14-9
MW:404.415
MF：C21H24O8

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Names and ldentifier
Properties
Use and Manufacturing
Msds
Computational chemical data
Related Questions
Realated Product Infomation

1. Names and Identifiers

1.1 Name: 3,5-DIHYDROXY-4'-METHOXYSTILBENE 3-O-BETA-D-GLUCOSIDE

1.2 Synonyms: 3,5-DIHYDROXY-4'-METHOXYSTILBENE 3-O-BETA-D-GLUCOSIDE; Deoxyrhaponticin; deoxyrhapontin from rhubarb root; DEOXYRHAPONTIN(RG);

1.3 CAS No.: 30197-14-9

1.4 CID: 5316606

1.5 Molecular Formula: C21H24O8

1.6 Inchi: InChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1

1.7 InChkey: MFMQRDLLSRLUJY-DXKBKAGUSA-N

1.8 Canonical Smiles: COC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O

1.9 Isomers Smiles: COC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

2. Properties

2.1 Solubility: Very 微溶 (0.77 g/L) (25 oC),

2.2 Storage: 2-8°C

2.3 Color/Form: Powder

2.4 pKa: 9.19±0.10(Predicted)

2.5 StorageTemp: 2-8°C

3. Use and Manufacturing

3.1 Description: Desoxyrhaponticin is a stilbene glycoside from the Tibetan nutritional food Rheum tanguticum Maxim. Desoxyrhaponticin is a Fatty acid synthase (FAS) inhibitor, and has apoptotic effect on human cancer cells[1].

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

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5. Synthesis Route

30197-14-9Total: 7 Synthesis Route

824-94-2 146 Suppliers

30197-14-9 15 Suppliers

572-09-8 137 Suppliers

30197-14-9 15 Suppliers

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6. Precursor and Product

precursor:

3462-97-3

187803-40-3

65728-21-4

824-94-2

572-09-8

197440-96-3

94356-29-3

product:

27208-80-6

7. Computed Properties

Molecular Weight：404.415g/mol
Molecular Formula：C₂₁H₂₄O₈
Compound Is Canonicalized：True
XLogP3-AA：404.14711772
Monoisotopic Mass：404.14711772
Complexity：521
Rotatable Bond Count：6
Hydrogen Bond Donor Count：5
Hydrogen Bond Acceptor Count：8
Topological Polar Surface Area：129
Heavy Atom Count：：29
Defined Atom Stereocenter Count：5
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：1
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADceB4PAAAAAAAAAAAAAAAAAAAAAAAAAA0YIAAAAAAAAABQAAAGgAACAAADBSwmAMyDoAABgCAAiBCAAACCAAgIAAIiAAGCIgdNyKGMRqieCClwBUPuAfA4BwOIAABCAAAAABAAAIQAAAAAAAAAAAAAA==

8. Toltal 14 Suppliers View more

Chengdu Gelipu Botechnology co.,ltd

Tel: Update Time:2021/04/26

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Nanjing Chemlin Chemical Co., Ltd.

Tel: Update Time:2024/03/04

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Alfa Biotechnology Co.,Ltd

Tel: Update Time:2019/02/23

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Chengdu Jioute Biotechnology Science and Technology Co.,LTD

Tel: Update Time:2019/02/25

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Chengdu Herbpurify Co., Ltd

Tel: Update Time:2019/02/23

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9. Related Questions

: What are the applications of 3,5-Dihydroxy-4'-methoxystilbene 3-O-beta-D-glucoside?Background and overview[1][2] Rhubarb is a well-known traditional Chinese medicinal material in my country. Its medicinal use was first recorded in the "Shen Nong's Materia Medica" and is listed as a ..

10. Realated Product Infomation