Glycoside
GD134774
Name:
NoneFormula:
C27H40O8N2Smiles:
CC12Cc3c(OC4OC(C(=O)O)C(O)C(O)C4O)n[nH]c3CC1CCC1C2CCC2(C)C1CCC2(C)OAglycone:
CC12Cc3c(O)n[nH]c3CC1CCC1C2CCC2(C)C1CCC2(C)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.85 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 520.62 | Num_heavy_atoms: | 37 |
| TPSA: | 165.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD54519
Formula: C21H32O2N2
Smiles:
CC12Cc3c(O)n[nH]c3CC1CCC1C2CCC2(C)C1CCC2(C)O| HBA: | 4 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | 3.82 | Num_rotatable_bonds: | 0 |
| MolWt: | 344.5 | Num_heavy_atoms: | 25 |
| TPSA: | 69.14 | NumAromaticRings: | 1 |
