Glycoside
GD034502
Name:
NoneFormula:
C17H25O8N3SSmiles:
CSC1OC(C(NC(=O)C=Cc2c(C)nc(O)nc2O)C(C)O)C(O)C(O)C1OAglycone:
Cc1nc(O)nc(O)c1C=CC(=O)NCC(C)OSugarmoiety:
CC(O)O.CSC(O)C(O)C(O)OOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.59 |
| AlogP: | -1.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 431.47 | Num_heavy_atoms: | 29 |
| TPSA: | 185.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD21931
Formula: C11H15O4N3
Smiles:
Cc1nc(O)nc(O)c1C=CC(=O)NCC(C)O| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 253.26 | Num_heavy_atoms: | 18 |
| TPSA: | 115.57 | NumAromaticRings: | 1 |
