Details of Ajugaside A
| IUPAC | (2R,3R,4S,5S,6R)-2-[[(1S,4aS,10aR)-5-hydroxy-7-(1-hydroxypropan-2-yl)-1,4a-dimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
| Canonical Smiles | CC(CO)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)COC4C(C(C(C(O4)CO)O)O)O)C)O)OC5C(C(C(C(O5)CO)O)O)O |
| Inchi | AKJKBBDQAFRAJQ-BVTVIDMQSA-N |
| PubChem ID | 10770608 |
| Smiles | CC(CO)c1cc2c(c(O)c1OC1OC(CO)C(O)C(O)C1O)C1(C)CCCC(C)(COC3OC(CO)C(O)C(O)C3O)C1CC2 |
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