Feedback

(20S)-ginsenoside Rg3

Properties

Image

Occurences in reactions

MNX_ID

MNXM725959

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	0

formula

C₄₂H₇₂O₁₃

charge

mass

784.49729

reference

chebi:67991

InChIKey

RWXIFXNRCLMQCD-JBVRGBGGSA-N

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

SMILES

CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(C)(C)[C@@H]3CC[C@]12C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:67991 chebi:67991	(20S)-ginsenoside Rg3 (20S)-propanaxadiol (3beta,12beta)-12,20-dihydroxydammar-24-en-3-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside 20S-propanaxadiol dammar-24-ene-12beta,20-diol, 3-beta-((2-O-beta-D-glucopyranosyl-beta-D-glucopyransoyl)oxy)- ginsenoside Rg3
metacyc.compound:CPD-12102 metacycM:CPD-12102	(20S)-ginsenoside Rg3 20(S)-propanaxidiol
seed.compound:cpd23239 seedM:cpd23239	20(S)-ginsenoside Rg3 (20S)-ginsenoside Rg3 20(S)-propanaxidiol Ginsenoside Rg3 ginsenoside Rg3
kegg.compound:C20778 keggC:C20778	Ginsenoside Rg3
keggC:M_C20778 seedM:M_cpd23239	secondary/obsolete/fantasy identifier