Glycoside
GD124059
Name:
NoneFormula:
C30H33O12N3Smiles:
CNCCOc1c(OC2OC(C(=O)O)C(O)C(O)C2O)cc2oc(-c3ccc(OCCc4ccc(N)[nH]4)cc3)cc(=O)c2c1OAglycone:
CNCCOc1c(O)cc2oc(-c3ccc(OCCc4ccc(N)[nH]4)cc3)cc(=O)c2c1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.33 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 12 |
| MolWt: | 627.6 | Num_heavy_atoms: | 45 |
| TPSA: | 239.19 | NumAromaticRings: | 4 |
Unique Aglycone
AD49257
Formula: C24H25O6N3
Smiles:
CNCCOc1c(O)cc2oc(-c3ccc(OCCc4ccc(N)[nH]4)cc3)cc(=O)c2c1O| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.21 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 9 |
| MolWt: | 451.48 | Num_heavy_atoms: | 33 |
| TPSA: | 142.97 | NumAromaticRings: | 4 |
