PhytoHub: Showing entry for Ginsenoside Rg2

Ginsenoside Rg2

Identification

PhytoHub ID

PHUB000954

Name

Ginsenoside Rg2

Synonyms

Not Available

CAS Number

Not Available

Average Mass

785.025

Monoisotopic Mass

784.497292378

Chemical Formula

C₄₂H₇₂O₁₃

IUPAC Name

(2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-2-{[(2R,8R,11R,16S)-5,16-dihydroxy-14-[(2S,5E)-2-hydroxy-6-methyloct-5-en-2-yl]-2,6,6,11-tetramethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-8-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

InChI Key

QOVKKEKBURQILF-HOJASPKOSA-N

InChI Identifier

InChI=1S/C42H72O13/c1-9-20(2)11-10-14-42(8,51)22-12-15-40(6)24-18-26(36-39(4,5)28(45)13-16-41(36,7)23(24)17-25(44)29(22)40)53-38-35(33(49)31(47)27(19-43)54-38)55-37-34(50)32(48)30(46)21(3)52-37/h11,21-38,43-51H,9-10,12-19H2,1-8H3/b20-11+/t21-,22?,23?,24?,25-,26+,27+,28?,29?,30-,31+,32+,33-,34+,35+,36?,37-,38+,40+,41+,42-/m0/s1

SMILES

CC\C(C)=C\CC[[email protected]](C)(O)C1CC[[email protected]@]2(C)C1[[email protected]@H](O)CC1C2C[[email protected]@H](O[[email protected]@H]2O[[email protected]](CO)[[email protected]@H](O)[[email protected]](O)[[email protected]]2O[[email protected]@H]2O[[email protected]@H](C)[[email protected]](O)[[email protected]@H](O)[[email protected]]2O)C2C(C)(C)C(O)CC[[email protected]]12C

Structure