Glycoside
GD134947
Name:
Epigynoside BFormula:
C34H56O11Smiles:
COC1C(OC2CCC3(C)C(=CCC4C3CCC3(C)C4CCOC3(O)C(C)OC3CC(O)C(O)C(C)O3)C2)OC(C)C(O)C1OAglycone:
CC(O)C1(O)OCCC2C3CC=C4CC(O)CCC4(C)C3CCC21CSugarmoiety:
CC1OC(O)CC(O)C1O.COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 640.81 | Num_heavy_atoms: | 45 |
| TPSA: | 156.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD54589
Formula: C21H34O4
Smiles:
CC(O)C1(O)OCCC2C3CC=C4CC(O)CCC4(C)C3CCC21C| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 3.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 350.5 | Num_heavy_atoms: | 25 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
