Glycoside
GD033348
Name:
STEREONSTEROID FFormula:
C29H46O6Smiles:
C=C[C@@H]1CC[C@@H]2[C@@H]3CC[C@@H]4C[C@H](O[C@@H]5O[C@H](C)[C@H](OC(C)=O)[C@H](O)[C@H]5O)CC[C@@]4(C)[C@H]3CC[C@@]12CAglycone:
C=CC1CCC2C3CCC4CC(O)CCC4(C)C3CCC12CSugarmoiety:
CC(=O)OC1C(C)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 4.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 490.68 | Num_heavy_atoms: | 35 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD13909
Formula: C21H34O
Smiles:
C=CC1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C| HBA: | 1 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.9 |
| AlogP: | 5.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.5 | Num_heavy_atoms: | 22 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
