Glycoside
GD118524
Name:
3beta-[(alpha-l-arabinopyranosyl)oxy]-20beta-hydroxyursan-28-oic acid del+Formula:
C35H56O7Smiles:
CC1C2C3CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CCC23CCC1(C)OC3=OAglycone:
CC1C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC23CCC1(C)OC3=OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 8 |
| HBD: | 3 | FractionCSP3: | 0.97 |
| AlogP: | 5.23 | Num_rotatable_bonds: | 2 |
| MolWt: | 588.83 | Num_heavy_atoms: | 42 |
| TPSA: | 105.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD21507
Formula: C30H48O3
Smiles:
CC1C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC23CCC1(C)OC3=O| HBA: | 3 | RingCount: | 7 |
| HBD: | 1 | FractionCSP3: | 0.97 |
| AlogP: | 6.76 | Num_rotatable_bonds: | 0 |
| MolWt: | 456.71 | Num_heavy_atoms: | 33 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
