Glycoside
GD141133
Name:
NoneFormula:
C40H63O12NSmiles:
CC(O)=NC1C(OC2CCC3(C(=O)O)C(=CCC4C3CCC3(C)C(C(C)C=CCC(C)C)CCC43)C2)OC(CO)C(O)C1OC1OC(CO)C(O)C1OAglycone:
CC(C)CC=CC(C)C1CCC2C3CC=C4CC(O)CCC4(C(=O)O)C3CCC12CSugarmoiety:
CC(O)=NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.85 |
| AlogP: | 3.5 | Num_rotatable_bonds: | 12 |
| MolWt: | 749.94 | Num_heavy_atoms: | 53 |
| TPSA: | 207.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD56881
Formula: C27H42O3
Smiles:
CC(C)CC=CC(C)C1CCC2C3CC=C4CC(O)CCC4(C(=O)O)C3CCC12C| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.81 |
| AlogP: | 6.23 | Num_rotatable_bonds: | 5 |
| MolWt: | 414.63 | Num_heavy_atoms: | 30 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
