Glycoside
GD004984
Name:
NoneFormula:
C30H47O12NSmiles:
CO[C@H]1[C@H](OC(C)=O)CC(=O)O[C@@H](C)C[C@@H]2O[C@H]2C=CC(=O)[C@@H](C)C[C@@H](CC=O)[C@H]1O[C@@H]1O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]1OAglycone:
COC1C(OC(C)=O)CC(=O)OC(C)CC2OC2C=CC(=O)C(C)CC(CC=O)C1OSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 7 |
| MolWt: | 613.7 | Num_heavy_atoms: | 43 |
| TPSA: | 170.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD00768
Formula: C22H32O9
Smiles:
COC1C(OC(C)=O)CC(=O)OC(C)CC2OC2C=CC(=O)C(C)CC(CC=O)C1O| HBA: | 9 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.73 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 440.49 | Num_heavy_atoms: | 31 |
| TPSA: | 128.73 | NumAromaticRings: | 0 |
