3-[(6-deoxyhexopyranosyl)oxy]-1,5,11,14,19-pentahydroxycard-20(22)-enolide
Chemical Structure Depiction of
3-[(6-deoxyhexopyranosyl)oxy]-1,5,11,14,19-pentahydroxycard-20(22)-enolide
3-[(6-deoxyhexopyranosyl)oxy]-1,5,11,14,19-pentahydroxycard-20(22)-enolide
Compound characteristics
| Compound ID: | N001-0004 |
| Compound Name: | 3-[(6-deoxyhexopyranosyl)oxy]-1,5,11,14,19-pentahydroxycard-20(22)-enolide |
| Molecular Weight: | 584.66 |
| Molecular Formula: | C29 H44 O12 |
| Smiles: | CC1C(C(C(C(OC2CC(C3(CO)C4C(CCC3(C2)O)C2(CCC(C3COC(C=3)=O)C2(C)C[C@H]4O)O)O)O1)O)O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -1.4112 |
| logD: | -1.4112 |
| logSw: | -2.6967 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 8 |
| Polar surface area: | 162.955 |
| InChI Key: | LPMXVESGRSUGHW-YGMDXYNPSA-N |