Glycoside
GD007650
Name:
NoneFormula:
C25H30O11N2Smiles:
O=C(O)CNC(=O)C(CC1OC(CO)C(O)C(O)C1O)N(CC(=O)O)C(=O)Cc1ccc2ccccc2c1Aglycone:
CC(C(=O)NCC(=O)O)N(CC(=O)O)C(=O)Cc1ccc2ccccc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.44 |
| AlogP: | -1.9 | Num_rotatable_bonds: | 11 |
| MolWt: | 534.52 | Num_heavy_atoms: | 38 |
| TPSA: | 214.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD06204
Formula: C19H20O6N2
Smiles:
CC(C(=O)NCC(=O)O)N(CC(=O)O)C(=O)Cc1ccc2ccccc2c1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.26 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 8 |
| MolWt: | 372.38 | Num_heavy_atoms: | 27 |
| TPSA: | 124.01 | NumAromaticRings: | 2 |
