Glycoside
GD154910
Name:
heloside aFormula:
C39H66O15Smiles:
CC(CO)CCC(OC1OC(CO)C(O)C(O)C1O)C(C)C1C(O)CC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3C(O)CC21CAglycone:
CC(CO)CCC(O)C(C)C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3C(O)CC21CSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 6 |
| HBD: | 11 | FractionCSP3: | 0.95 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 12 |
| MolWt: | 774.94 | Num_heavy_atoms: | 54 |
| TPSA: | 259.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD11368
Formula: C27H46O5
Smiles:
CC(CO)CCC(O)C(C)C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3C(O)CC21C| HBA: | 5 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 450.66 | Num_heavy_atoms: | 32 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
