| 2D Structure | |
| CID | 101599072 |
| IUPAC Name | (2S,3S,4S,5R,6S)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid |
| InChI | InChI=1S/C41H62O14/c1-36(2)23-8-11-41(7)31(21(42)16-19-20-17-38(4,35(50)51)13-12-37(20,3)14-15-40(19,41)6)39(23,5)10-9-24(36)53-34-30(27(46)26(45)29(54-34)32(48)49)55-33-28(47)25(44)22(43)18-52-33/h16,20,22-31,33-34,43-47H,8-15,17-18H2,1-7H3,(H,48,49)(H,50,51)/t20-,22-,23-,24-,25-,26-,27-,28+,29-,30+,31+,33-,34-,37+,38-,39-,40+,41+/m0/s1 |
| InChI Key | DTMJARJUCFBMFR-ZHGMGIEYSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C41H62O14 |
| Molecular Weight | 778.9 |
| synonyms | ['Araboglycyrrhizin', 'RefChem:916099', '(2S,3S,4S,5R,6S)-6-(((3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl)oxy)-3,4-dihydroxy-5-((2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl)oxyoxane-2-carboxylic acid', '121687-83-0', '3-O-(alpha-L-arabinopyranosyl(1-2)-beta-D-glucuronopyranosyl)glycyrrhetic acid', 'CHEMBL3314504'] |
From Pubchem