Glycoside
GD030091
Name:
NoneFormula:
C32H32O11N4Smiles:
O=C1c2c(c3c4ccc(O)cc4n([C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NC1C(O)CCCC1OAglycone:
O=C1c2c(c3c4ccc(O)cc4[nH]c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NC1C(O)CCCC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 8 |
| HBD: | 10 | FractionCSP3: | 0.38 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 648.63 | Num_heavy_atoms: | 47 |
| TPSA: | 241.2 | NumAromaticRings: | 5 |
Unique Aglycone
AD19494
Formula: C26H22O6N4
Smiles:
O=C1c2c(c3c4ccc(O)cc4[nH]c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NC1C(O)CCCC1O| HBA: | 10 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.23 |
| AlogP: | 2.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 486.48 | Num_heavy_atoms: | 36 |
| TPSA: | 161.91 | NumAromaticRings: | 5 |
