Glycoside
GD124129
Name:
NoneFormula:
C34H32O14N2Smiles:
Nc1ccc(C(O)COc2ccc(-c3cc(=O)c4c(O)c(OCc5cccc(O)c5)c(OC5OC(C(=O)O)C(O)C(O)C5O)cc4o3)cc2)[nH]1Aglycone:
Nc1ccc(C(O)COc2ccc(-c3cc(=O)c4c(O)c(OCc5cccc(O)c5)c(O)cc4o3)cc2)[nH]1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 6 |
| HBD: | 10 | FractionCSP3: | 0.24 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 11 |
| MolWt: | 692.63 | Num_heavy_atoms: | 50 |
| TPSA: | 267.62 | NumAromaticRings: | 5 |
Unique Aglycone
AD48993
Formula: C28H24O8N2
Smiles:
Nc1ccc(C(O)COc2ccc(-c3cc(=O)c4c(O)c(OCc5cccc(O)c5)c(O)cc4o3)cc2)[nH]1| HBA: | 10 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.11 |
| AlogP: | 4.18 | Num_rotatable_bonds: | 8 |
| MolWt: | 516.51 | Num_heavy_atoms: | 38 |
| TPSA: | 171.4 | NumAromaticRings: | 5 |
