Ginsenoside Rg3

enlarge

Systematic / IUPAC Name: (3β,12β)-12,20-Dihydroxydammar-24-en-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside

ID: Reference6141

Other Names: (20S)-Ginsenoside Rg3;
(20S)-Propanaxadiol;
20(S)-Ginsenoside Rg3;
20S-Propanaxadiol;
Dammar-24-ene-12β,20-diol, 3-β-[(2-O-β-D-glucopyranosyl-β-D-glucopyransoyl)oxy]- ; more

Formula: C42H72O13

Class: Endogenous Metabolites Natural Products/Medicines

Spectral Data

Ginsenoside Rg3 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 481
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers IT; FT
Last Modification 12/12/2016 8:30:16 AM
View Mass Spec Data > >

Identificators

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
InChI Key RWXIFXNRCLMQCD-JBVRGBGGSA-N
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
CAS 14197605
Splash
Other Names (20S)-Ginsenoside Rg3;
(20S)-Propanaxadiol;
20(S)-Ginsenoside Rg3;
20S-Propanaxadiol;
Dammar-24-ene-12β,20-diol, 3-β-[(2-O-β-D-glucopyranosyl-β-D-glucopyransoyl)oxy]- ;
Rg3;
(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

In Other Databases

PubChem 9918693
ChemSpider 8094338
ChEBI CHEBI:67991
ChEMBL CHEMBL398412