Glycoside
GD131971
Name:
NoneFormula:
C37H62O13Smiles:
CC(C)C(C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12O)OC1OC(CO)C(O)C1OC1OCC(O)C(O)C1OAglycone:
CC(C)C(O)C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12OSugarmoiety:
OCC1OC(O)C(OC2OCC(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.95 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 9 |
| MolWt: | 714.89 | Num_heavy_atoms: | 50 |
| TPSA: | 218.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD02524
Formula: C27H46O5
Smiles:
CC(C)C(O)C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12O| HBA: | 5 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 450.66 | Num_heavy_atoms: | 32 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
