Glycoside
GD154493
Name:
2-({1-ethenyl-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl}oxy)-4,5-dihydroxy-6-methyloxan-3-yl acetateFormula:
C29H46O6Smiles:
C=CC1CCC2C3CCC4CC(OC5OC(C)C(O)C(O)C5OC(C)=O)CCC4(C)C3CCC12CAglycone:
C=CC1CCC2C3CCC4CC(O)CCC4(C)C3CCC12CSugarmoiety:
CC(=O)OC1C(O)OC(C)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 |
