Glycoside
GD004711
Name:
NoneFormula:
C27H23O7N3Smiles:
CO[C@@H]1[C@H](CO)O[C@H](n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)C(=O)NC4=O)[C@H](O)[C@H]1OAglycone:
O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.26 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 501.5 | Num_heavy_atoms: | 37 |
| TPSA: | 146.04 | NumAromaticRings: | 5 |
Unique Aglycone
AD04076
Formula: C20H11O2N3
Smiles:
O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21| HBA: | 5 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 325.33 | Num_heavy_atoms: | 25 |
| TPSA: | 77.75 | NumAromaticRings: | 5 |
