Glycoside
GD131794
Name:
Yibeinoside CFormula:
C39H65O12NSmiles:
CC1CCC(C(C)C2CCC3C4CC(=O)C5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)CCC5(C)C4CCC23C)NC1Aglycone:
CC1CCC(C(C)C2CCC3C4CC(=O)C5CC(O)CCC5(C)C4CCC23C)NC1Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 7 |
| HBD: | 8 | FractionCSP3: | 0.97 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 8 |
| MolWt: | 739.94 | Num_heavy_atoms: | 52 |
| TPSA: | 207.63 | NumAromaticRings: | 0 |
Unique Aglycone
AD53378
Formula: C27H45O2N
Smiles:
CC1CCC(C(C)C2CCC3C4CC(=O)C5CC(O)CCC5(C)C4CCC23C)NC1| HBA: | 3 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.96 |
| AlogP: | 5.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 415.66 | Num_heavy_atoms: | 30 |
| TPSA: | 49.33 | NumAromaticRings: | 0 |
