loader
Please Wait
Applying Filters...

Euroapi Company Header Euroapi Company Header

X

Technical details about Ginsenoside Rg3, learn more about the structure, uses, toxicity, action, side effects and more

Client Email Product
Menu
2D Structure
1. Also known as: 14197-60-5, 20s-ginsenoside rg3, (20s)-propanaxadiol, 20s-propanaxadiol, (20s)-ginsenoside rg3, S-ginsenoside rg3
Molecular Formula
C42H72O13
Molecular Weight
785.0  g/mol
InChI Key
RWXIFXNRCLMQCD-JBVRGBGGSA-N
FDA UNII
227D367Y57

ginsenoside rg3 is a natural product found in Panax ginseng, Panax notoginseng, and other organisms with data available.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-2-[[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-12-hydroxy-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
2.1.2 InChI
InChI=1S/C42H72O13/c1-21(2)10-9-14-42(8,51)22-11-16-41(7)29(22)23(45)18-27-39(5)15-13-28(38(3,4)26(39)12-17-40(27,41)6)54-37-35(33(49)31(47)25(20-44)53-37)55-36-34(50)32(48)30(46)24(19-43)52-36/h10,22-37,43-51H,9,11-20H2,1-8H3/t22-,23+,24+,25+,26-,27+,28-,29-,30+,31+,32-,33-,34+,35+,36-,37-,39-,40+,41+,42-/m0/s1
2.1.3 InChI Key
RWXIFXNRCLMQCD-JBVRGBGGSA-N
2.1.4 Canonical SMILES
CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O)C)O)C
2.1.5 Isomeric SMILES
CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)O)C)O)C
2.2 Other Identifiers
2.2.1 UNII
227D367Y57
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 20(r)-ginsenoside Rg(3)

2. 20(s)-ginsenoside Rg(3)

3. 20s-ginsenoside Rg3

4. 3-o-beta-d-glucopyranosyl-(1->2)-beta-d-glucopyranosyldammar-24-ene-3beta,12beta,20s-triol

5. Beta-d-glucopyranoside, (3beta,12beta)-12,20-dihydroxydammar-24-en-3-yl 2-o-beta-d-glucopyranosyl-

6. Ginsenoside 20-rg3

7. Ginsenoside Rg(3)

8. Ginsenoside Rg3, (+)-

9. Ginsenoside Rg3, (s)-

10. S-ginsenoside Rg3

2.3.2 Depositor-Supplied Synonyms

1. 14197-60-5

2. 20s-ginsenoside Rg3

3. (20s)-propanaxadiol

4. 20s-propanaxadiol

5. (20s)-ginsenoside Rg3

6. S-ginsenoside Rg3

7. 20(s)-ginsenoside Rg3

8. 20(s)-ginsenoside-rg3

9. 20(s)-propanaxidiol

10. Chembl398412

11. Chebi:67991

12. (2s,3r,4s,5s,6r)-2-[(2r,3r,4s,5s,6r)-4,5-dihydroxy-2-[[(3s,5r,8r,9r,10r,12r,13r,14r,17s)-12-hydroxy-17-[(2s)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

13. 11019-45-7

14. 227d367y57

15. (r)ginsenoside-rg3

16. Ginsenoside 20-rg3

17. Ginsenoside Rg3, (s)-

18. Ginsenoside Rg3, (+)-

19. Unii-227d367y57

20. Rg3

21. Mfcd06410950

22. Ginsenoside Rg3,(s)

23. 2'(r)-ginsenoside-rg3

24. Gtpl7658

25. Ginsenoside Rg3 [who-dd]

26. Dtxsid101316982

27. Hms3886b14

28. Bdbm50317537

29. Ginsenoside Rg3, Analytical Standard

30. S9022

31. Zinc96085900

32. Ginsenoside Rg3, >=98% (hplc)

33. Akos037514674

34. Ccg-270472

35. (3beta,12beta)-12,20-dihydroxydammar-24-en-3-yl 2-o-beta-d-glucopyranosyl-beta-d-glucopyranoside

36. As-56617

37. Dammar-24-ene-12-beta,20-diol, 3-beta-((2-o-beta-d-glucopyranosyl-beta-d-glucopyransoyl)oxy)-

38. C20778

39. 197g605

40. Q-100154

41. Q27077807

42. .beta.-d-glucopyranoside, (3.beta.,12.beta.)-12,20-dihydroxydammar-24-en-3-yl 2-o-.beta.-d-glucopyranosyl-

43. 3-o-.beta.-d-glucopyranosyl-(1->2)-.beta.-d-glucopyranosyldammar-24-ene-3.beta.,12.beta.,20s-triol

44. Beta-d-glucopyranoside, (3-beta,12-beta)-12,20-dihydroxydammar-24-en-3-yl 2-o-beta-d-glucopyranosyl-

45. Dammar-24-ene-12beta,20-diol, 3-beta-((2-o-beta-d-glucopyranosyl-beta-d-glucopyransoyl)oxy)-

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 785.0 g/mol
Molecular Formula C42H72O13
XLogP34
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count13
Rotatable Bond Count10
Exact Mass784.49729235 g/mol
Monoisotopic Mass784.49729235 g/mol
Topological Polar Surface Area219 Ų
Heavy Atom Count55
Formal Charge0
Complexity1370
Isotope Atom Count0
Defined Atom Stereocenter Count20
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Antineoplastic Agents, Phytogenic

Agents obtained from higher plants that have demonstrable cytostatic or antineoplastic activity. (See all compounds classified as Antineoplastic Agents, Phytogenic.)


Post Enquiry
POST ENQUIRY