Glycoside
GD153768
Name:
6-DesacetylscillirosideFormula:
C30H42O11Smiles:
CC12CCC(OC3OC(CO)C(O)C(O)C3O)C=C1C(O)CC1(O)C2CCC2(C)C(c3ccc(=O)oc3)CCC21OAglycone:
CC12CCC(O)C=C1C(O)CC1(O)C2CCC2(C)C(c3ccc(=O)oc3)CCC21OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.77 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 578.66 | Num_heavy_atoms: | 41 |
| TPSA: | 190.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD61127
Formula: C24H32O6
Smiles:
CC12CCC(O)C=C1C(O)CC1(O)C2CCC2(C)C(c3ccc(=O)oc3)CCC21O| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 416.51 | Num_heavy_atoms: | 30 |
| TPSA: | 111.13 | NumAromaticRings: | 1 |
