Glycoside
GD033568
Name:
NoneFormula:
C55H101O9NSmiles:
C=CCO[C@H]1[C@H](OC[C@H](NC(=O)[C@H](O)CCC=CCCCC[C@@H]2C[C@H]2CCCCCCCCCC)[C@H](O)CCCCCCC[C@@H]2C[C@H]2CCCCCCCCCC)O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
CCCCCCCCCCC1CC1CCCCC=CCCC(O)C(=O)NC(CO)C(O)CCCCCCCC1CC1CCCCCCCCCCSugarmoiety:
C=CCOC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.91 |
| AlogP: | 11.18 | Num_rotatable_bonds: | 44 |
| MolWt: | 920.41 | Num_heavy_atoms: | 65 |
| TPSA: | 157.94 | NumAromaticRings: | 0 |
Unique Aglycone
AD05248
Formula: C46H87O4N
Smiles:
CCCCCCCCCCC1CC1CCCCC=CCCC(O)C(=O)NC(CO)C(O)CCCCCCCC1CC1CCCCCCCCCC| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | 12.15 | Num_rotatable_bonds: | 38 |
| MolWt: | 718.2 | Num_heavy_atoms: | 51 |
| TPSA: | 89.79 | NumAromaticRings: | 0 |
