Glycoside
GD030829
Name:
NoneFormula:
C31H49O9NSmiles:
CC(C)ON(OC1OC[C@H](O)[C@H](O)[C@H]1O)[C@@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@H]2CC[C@]2(C)[C@H](C4=CC(=O)OC4)CC[C@@]32O)C1Aglycone:
CC(C)ON(O)C1CCC2(C)C(CCC3C2CCC2(C)C(C4=CC(=O)OC4)CCC32O)C1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 6 |
| MolWt: | 579.73 | Num_heavy_atoms: | 41 |
| TPSA: | 138.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD19937
Formula: C26H41O5N
Smiles:
CC(C)ON(O)C1CCC2(C)C(CCC3C2CCC2(C)C(C4=CC(=O)OC4)CCC32O)C1| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.88 |
| AlogP: | 4.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 447.62 | Num_heavy_atoms: | 32 |
| TPSA: | 79.23 | NumAromaticRings: | 0 |
