Glycoside
GD144443
Name:
NoneFormula:
C40H41O14N5Smiles:
N=C1N=C(O)C2=NCN(c3ccccc3C(CCCO)c3cc4c(c(OCC(O)CC=O)c3OC3OC(CO)C(O)C(O)C3O)C(=O)c3cc(CO)ccc3C4=O)C2=N1Aglycone:
N=C1N=C(O)C2=NCN(c3ccccc3C(CCCO)c3cc4c(c(OCC(O)CC=O)c3O)C(=O)c3cc(CO)ccc3C4=O)C2=N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 7 |
| HBD: | 9 | FractionCSP3: | 0.38 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 15 |
| MolWt: | 815.79 | Num_heavy_atoms: | 59 |
| TPSA: | 304.91 | NumAromaticRings: | 3 |
Unique Aglycone
AD58054
Formula: C34H31O9N5
Smiles:
N=C1N=C(O)C2=NCN(c3ccccc3C(CCCO)c3cc4c(c(OCC(O)CC=O)c3O)C(=O)c3cc(CO)ccc3C4=O)C2=N1| HBA: | 14 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.26 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 12 |
| MolWt: | 653.65 | Num_heavy_atoms: | 48 |
| TPSA: | 225.76 | NumAromaticRings: | 3 |
