Glycoside
GD127348
Name:
Caohuoside DFormula:
C28H34O12Smiles:
COc1ccc(-c2oc3c(CCC(C)(C)OC)c(OC4OC(CO)C(O)C(O)C4O)cc(O)c3c(=O)c2O)cc1Aglycone:
COc1ccc(-c2oc3c(CCC(C)(C)OC)c(O)cc(O)c3c(=O)c2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 9 |
| MolWt: | 562.57 | Num_heavy_atoms: | 40 |
| TPSA: | 188.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD51571
Formula: C22H24O7
Smiles:
COc1ccc(-c2oc3c(CCC(C)(C)OC)c(O)cc(O)c3c(=O)c2O)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.32 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 6 |
| MolWt: | 400.43 | Num_heavy_atoms: | 29 |
| TPSA: | 109.36 | NumAromaticRings: | 3 |
