Glycoside
GD015563
Name:
NoneFormula:
C32H29O7N5Smiles:
O=C1c2c(c3c4ccccc4n(C4OC(CO)C(O)C(O)C4O)c3c3[nH]c4ccccc4c23)C(=O)N1CCCn1ccnc1Aglycone:
O=C1c2c(c3c4ccccc4[nH]c3c3[nH]c4ccccc4c23)C(=O)N1CCCn1ccnc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 8 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 595.61 | Num_heavy_atoms: | 44 |
| TPSA: | 166.07 | NumAromaticRings: | 6 |
Unique Aglycone
AD11300
Formula: C26H19O2N5
Smiles:
O=C1c2c(c3c4ccccc4[nH]c3c3[nH]c4ccccc4c23)C(=O)N1CCCn1ccnc1| HBA: | 7 | RingCount: | 7 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 4.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 433.47 | Num_heavy_atoms: | 33 |
| TPSA: | 86.78 | NumAromaticRings: | 6 |
