Glycoside
GD137412
Name:
NoneFormula:
C27H33O14NSmiles:
COc1c2ccoc2nc2c(OC)c(OC3OC(C)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3OC(C)=[O+])ccc12Aglycone:
COc1c2ccoc2nc2c(OC)c(O)ccc12Sugarmoiety:
CC(=O)OC1C(O)OC(C)C(O)C1OC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 8 |
| MolWt: | 595.55 | Num_heavy_atoms: | 42 |
| TPSA: | 211.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD01645
Formula: C13H11O4N
Smiles:
COc1c2ccoc2nc2c(OC)c(O)ccc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.23 | Num_heavy_atoms: | 18 |
| TPSA: | 64.72 | NumAromaticRings: | 3 |
