Glycoside
GD028194
Name:
NoneFormula:
C22H22O6N2Smiles:
CO[C@@H]1[C@H](CO)O[C@H](Oc2c3c4c(ccnc4c4ccccc24)C=CN3)[C@H](O)[C@H]1OAglycone:
Oc1c2c3c(ccnc3c3ccccc13)C=CN2Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.43 | Num_heavy_atoms: | 30 |
| TPSA: | 113.3 | NumAromaticRings: | 3 |
Unique Aglycone
AD10240
Formula: C15H10ON2
Smiles:
Oc1c2c3c(ccnc3c3ccccc13)C=CN2| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 0 |
| MolWt: | 234.26 | Num_heavy_atoms: | 18 |
| TPSA: | 45.15 | NumAromaticRings: | 3 |
