Glycoside
GD119198
Name:
6-({[1-(5-ethyl-6-methylheptan-2-yl)-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}methyl)oxane-2,3,4,5-tetrolFormula:
C35H62O6Smiles:
CCC(CCC(C)C1CCC2C3CCC4CC(OCC5OC(O)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)CAglycone:
CCC(CCC(C)C1CCC2C3CCC4CC(OC)CCC4(C)C3CCC12C)C(C)CSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 5.93 | Num_rotatable_bonds: | 9 |
| MolWt: | 578.88 | Num_heavy_atoms: | 41 |
| TPSA: | 99.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD47716
Formula: C30H54O
Smiles:
CCC(CCC(C)C1CCC2C3CCC4CC(OC)CCC4(C)C3CCC12C)C(C)C| HBA: | 1 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 8.76 | Num_rotatable_bonds: | 7 |
| MolWt: | 430.76 | Num_heavy_atoms: | 31 |
| TPSA: | 9.23 | NumAromaticRings: | 0 |
