Glycoside
GD155904
Name:
NoneFormula:
C35H39O12N5Smiles:
NC1N=C(O)C2NCN(c3ccccc3Cc3cc4c(c(OCCO)c3OC3OC(CO)C(O)C(O)C3O)C(=O)c3cc(CO)ccc3C4=O)C2N1Aglycone:
NC1N=C(O)C2NCN(c3ccccc3Cc3cc4c(c(OCCO)c3O)C(=O)c3cc(CO)ccc3C4=O)C2N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 7 |
| HBD: | 11 | FractionCSP3: | 0.4 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 10 |
| MolWt: | 721.72 | Num_heavy_atoms: | 52 |
| TPSA: | 269.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD61786
Formula: C29H29O7N5
Smiles:
NC1N=C(O)C2NCN(c3ccccc3Cc3cc4c(c(OCCO)c3O)C(=O)c3cc(CO)ccc3C4=O)C2N1| HBA: | 12 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.28 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 7 |
| MolWt: | 559.58 | Num_heavy_atoms: | 41 |
| TPSA: | 189.97 | NumAromaticRings: | 3 |
