Glycoside
GD125591
Name:
Sf2446B1Formula:
C34H35O14NSmiles:
COC(=O)c1c(C)cc2c(c1O)C1(O)C(=O)c3cc4c(c(O)c3C(=O)C1(OC)CC2)C(=O)C=C(NC1OC(C)C(OC)C(O)C1OC)C4=OAglycone:
COC(=O)c1c(C)cc2c(c1O)C1(O)C(=O)c3cc4c(c(O)c3C(=O)C1(OC)CC2)C(=O)C=C(N)C4=OSugarmoiety:
COC1C(C)OC(O)C(OC)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 6 |
| MolWt: | 681.65 | Num_heavy_atoms: | 49 |
| TPSA: | 224.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD09341
Formula: C26H21O10N
Smiles:
COC(=O)c1c(C)cc2c(c1O)C1(O)C(=O)c3cc4c(c(O)c3C(=O)C1(OC)CC2)C(=O)C=C(N)C4=O| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 507.45 | Num_heavy_atoms: | 37 |
| TPSA: | 190.52 | NumAromaticRings: | 2 |
