Glycoside
GD130535
Name:
Hybridaphniphylline BFormula:
C37H47O11NSmiles:
CC1CN2CC3CCC4=C5C6(CCC57C(=O)C1CC2C37C)CC4C1OC(OC2OC(CO)C(O)C(O)C2O)C2C(CO)=CC3OC(=O)C16C32Aglycone:
CC1CN2CC3CCC4=C5C6(CCC57C(=O)C1CC2C37C)CC4C1OC(O)C2C(CO)=CC3OC(=O)C16C32Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 11 |
| HBD: | 5 | FractionCSP3: | 0.84 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 4 |
| MolWt: | 681.78 | Num_heavy_atoms: | 49 |
| TPSA: | 175.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD52898
Formula: C31H37O6N
Smiles:
CC1CN2CC3CCC4=C5C6(CCC57C(=O)C1CC2C37C)CC4C1OC(O)C2C(CO)=CC3OC(=O)C16C32| HBA: | 7 | RingCount: | 10 |
| HBD: | 2 | FractionCSP3: | 0.81 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 519.64 | Num_heavy_atoms: | 38 |
| TPSA: | 96.3 | NumAromaticRings: | 0 |
