Glycoside
GD137322
Name:
NoneFormula:
C34H39O11N3Smiles:
Cc1cc(=O)c2cc3c(c(-n4cc5cc[nH]c5c4)c2o1)OC1(CC=CC(C2CN=C(O)C2)C1)C(OOCC(O)C(O)C(O)C(O)CO)C3Aglycone:
Cc1cc(=O)c2cc3c(c(-n4cc5cc[nH]c5c4)c2o1)OC1(CC=CC(C2CN=C(O)C2)C1)C(O)C3Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.47 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 10 |
| MolWt: | 665.7 | Num_heavy_atoms: | 48 |
| TPSA: | 212.36 | NumAromaticRings: | 4 |
Unique Aglycone
AD45441
Formula: C28H27O5N3
Smiles:
Cc1cc(=O)c2cc3c(c(-n4cc5cc[nH]c5c4)c2o1)OC1(CC=CC(C2CN=C(O)C2)C1)C(O)C3| HBA: | 8 | RingCount: | 7 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 4.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 485.54 | Num_heavy_atoms: | 36 |
| TPSA: | 112.98 | NumAromaticRings: | 4 |
