Glycoside
GD129102
Name:
6-{[8-hydroxy-1-(1-methoxyethoxy)-1,9a,11a-trimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-2-methyloxane-3,4-diolFormula:
C29H50O7Smiles:
COC(C)OC1(C)CCC2C3CCC4CC(OC5CC(O)C(O)C(C)O5)C(O)CC4(C)C3CCC21CAglycone:
COC(C)OC1(C)CCC2C3CCC4CC(O)C(O)CC4(C)C3CCC21CSugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 4.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 510.71 | Num_heavy_atoms: | 36 |
| TPSA: | 97.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD52290
Formula: C23H40O4
Smiles:
COC(C)OC1(C)CCC2C3CCC4CC(O)C(O)CC4(C)C3CCC21C| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 4.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 380.57 | Num_heavy_atoms: | 27 |
| TPSA: | 58.92 | NumAromaticRings: | 0 |
